CPOSS Database

193 of 193 cases

#CaseFolderChemiscope visualizations
1Azabicyclononanedione1.BlindTest/IVAzabicyclononanedioneA
2Diiodoanthanthrone1.BlindTest/IXDiiodoanthanthroneA
3BTVIII1.BlindTest/VIIIDiaminoDinitroPyridineOxideA
4Azetidine1.BlindTest/XIAzetidineA
5BTXII1.BlindTest/XIIDiaminoDinitroPyridineOxideA
6BTXIII1.BlindTest/XIIIDiaminoDinitroPyridineOxideA
7BTXIV1.BlindTest/XIV2CannabinolTetramethylpyrazineA
8BTXIX1.BlindTest/XIX/BTXIXDiaminoDinitroPyridineOxideA
9QuinoliniumFumarate1.BlindTest/XIX/QuinoliniumFumarateQuinoliniumFumarateA
10AminoPyrimidine1.BlindTest/XV/AminoPyrimidineAminoPyrimidineA
11BTXV1.BlindTest/XV/BTXVAminoPyrimidineA
12OtolicAcid1.BlindTest/XV/OtolicAcidOtolicAcidB
13BTXVI1.BlindTest/XVIDiaminoDinitroPyridineOxideA
14BTXVII1.BlindTest/XVIIDiaminoDinitroPyridineOxideA
15BTXVIII1.BlindTest/XVIIIBTXVIIIB
16BTXX1.BlindTest/XXBenzylTetrazoleA
17GallicAcidMH1.BlindTest/XXIGallicAcidA
18BTXXII1.BlindTest/XXIIDiaminoDinitroPyridineOxideA
19BXXIII1.BlindTest/XXIIIBTXXVIIIABTXXVIIIB
20BTXXIV1.BlindTest/XXIVBTXXIVA
21BTXXIX1.BlindTest/XXIX2CannabinolTetramethylpyrazineA
22BTXXVC1.BlindTest/XXVCBTXXVCA
23BTXXVI1.BlindTest/XXVIDiaminoDinitroPyridineOxideA
24XXVII1.BlindTest/XXVIIBTXXVIIIABTXXVIIIB
25BTXXVIII1.BlindTest/XXVIIIBTXXVIIIABTXXVIIIB
262CannabinolTetramethylpyrazine1.BlindTest/XXX/2CannabinolTetramethylpyrazine2CannabinolTetramethylpyrazineACannabinolACannabinolTetramethylpyrazineATetramethylpyrazineA
27Cannabinol2Tetramethylpyrazine1.BlindTest/XXX/Cannabinol2Tetramethylpyrazine2CannabinolTetramethylpyrazineACannabinolACannabinolTetramethylpyrazineATetramethylpyrazineA
28Cannabinol1.BlindTest/XXX/Cannabinol2CannabinolTetramethylpyrazineACannabinolACannabinolTetramethylpyrazineATetramethylpyrazineA
29CannabinolTetramethylpyrazine1.BlindTest/XXX/CannabinolTetramethylpyrazine2CannabinolTetramethylpyrazineACannabinolACannabinolTetramethylpyrazineATetramethylpyrazineA
30Tetramethylpyrazine1.BlindTest/XXX/Tetramethylpyrazine2CannabinolTetramethylpyrazineACannabinolACannabinolTetramethylpyrazineATetramethylpyrazineA
31BTXXXI1.BlindTest/XXXIBTXXXIABTXXXIB
32BTXXXII1.BlindTest/XXXIIBTXXXIIABTXXXIIB
33XXXIII1.BlindTest/XXXIIIBTXXVIIIABTXXVIIIB
34Carbamazepine1.CarbamazepineFamilyCarbamazepinePicolinamideA
35Cyheptamide1.CarbamazepineFamilyCarbamazepinePicolinamideACyheptamideACyheptamideB
36Cytenamide1.CarbamazepineFamilyCarbamazepinePicolinamideACytenamideACytenamideB
37Dihydrocarbamazepine1.CarbamazepineFamilyDihydrocarbamazepineADihydrocarbamazepineB
38Oxcarbazepine1.CarbamazepineFamilyCarbamazepinePicolinamideAOxcarbazepineA
39BipyridineAminobenzoic1-11.CocrystalsAminobenzoicAcidA
40BipyridineAminobenzoic1-21.CocrystalsAminobenzoicAcidA
41BipyridineSuccinicAcid1.CocrystalsSuccinicAcidD
42CaffeineHydroxybenzoicAcidCocrystals1.CocrystalsCaffeineACaffeineC
43CaffeineParacetamolCocrystal1.CocrystalsCaffeineParacetamolA
44CarbamazepinePicolinamide1.CocrystalsCarbamazepinePicolinamideA
45DicyanobenzeneSuccinicAcid1.CocrystalsDicyanobenzeneA
46NitrophenylaceticAminobenzoic1.CocrystalsNitrophenylAceticAcidA
47DiChloroNitroBenzenes1.DiChloroNitroBenzene24-dichloronitrobenzeneA24-dichloronitrobenzeneB
48FenamicAcid1.FenamateFamilyFlufenamicAcidA
49FlufenamicAcid1.FenamateFamilyFlufenamicAcidA
50MefenamicAcid1.FenamateFamilyFlufenamicAcidA
51NiflumicAcid1.FenamateFamilyGentisicAcidDHA
52TolfenamicAcid1.FenamateFamilyFlufenamicAcidA
535-fluoroisatin1.Fluoroisatins5fluoroisatinA
547-fluoroisatin1.Fluoroisatins7fluoroisatinA
55FluoroToluene1.Fluorotoluenes3-fluorotolueneA
56FOX7_and_TransFOX71.FOX7FOX7AFOX7BTransFOX7A
57Amoxapine1.OlanzapineFamily/AmoxapineAmoxapineAAmoxapineB
58Clozapine1.OlanzapineFamily/ClozapineClozapineAClozapineB
59Loxapine1.OlanzapineFamily/LoxapineLoxapineALoxapineB
60Olanzapine1.OlanzapineFamily/OlanzapineOlanzapineAOlanzapineB
614cyanopyridine4fluorobenzoicacid1.SaltOrCocrystalPyridineA
624dimethylaminopyridinemaleicacid1.SaltOrCocrystal4dimethylaminopyridinemaleicacidA4dimethylaminopyridiniummaleateA
63pyridineisophthalicacid1.SaltOrCocrystalpyridineisophthalicacidA
642-halobenzamides1.SubstitutedBenzamides2aminobenzamideA3aminobenzamideA
652aminobenzamide1.SubstitutedBenzamides/2aminobenzamide2aminobenzamideA
662bromobenzamide1.SubstitutedBenzamides/2bromobenzamide2bromobenzamideA
672chlorobenzamide1.SubstitutedBenzamides/2chlorobenzamide2chlorobenzamideA2chlorobenzamideB2chlorobenzamideC
682fluorobenzamide1.SubstitutedBenzamides/2fluorobenzamide2fluorobenzamideA2fluorobenzamideB
693aminobenzamide1.SubstitutedBenzamides/3aminobenzamide3aminobenzamideA
704aminobenzamide1.SubstitutedBenzamides/4aminobenzamide4aminobenzamideA
71aminobenzamides1.SubstitutedBenzamides2aminobenzamideA
72SubstitutedNitroBenzenes1.SubstitutedNitroBenzoicAcids2C4NBAA
735-formyluracil1.UracilsFormyluracilA
74Uracils1.Uracils5nitrouracilA
75Xylenes1.XylenesO-XyleneA
76AcridineAcridineAcridineB
77AdenineAdenineAdenineAAdenineB
78AlloxanAlloxanAlloxanA
79AmantadineHydrochlorideAmantadineHydrochlorideAmantadineHydrochlorideA
80AminobenzoicAcidAminobenzoicAcidAminobenzoicAcidA
81AnisoleAnisoleAnisoleA
82AnthraceneAnthraceneAnthraceneA
83AspirinAspirinAspirinA
845-azauracilAzauracil5AzauracilA
85BarbituricAcidBarbituricAcidBarbituricAcidA
86BenzophenanthreneBenzophenanthreneBenzophenanthreneA
87BenzylTetrazoleBenzylTetrazoleBenzylTetrazoleA
88bResorcylicAcidBetaResorcylicAcidHydratesbResorcylicAcidDihydrateA
89BipyridineBipyridineBipyridineABipyridineB
90BromoAminoBenzoicAcidBromoAminoBenzoicAcidAminobenzoicAcidA
91CaffeineCaffeineCaffeineACaffeineC
92CarbonicAcidCarbonicAcidCarbonicAcidA
93ChalconeChalconeChalconeA
942-ChlorobenzoicAcidChlorobenzoicAcidChlorobenzoicAcidA
95ChloroDibenzosuberenonePiperidineChlorodibenzosuberoneDibenzosuberenoneA
96ChloroformChloroformChloroformA
973ChloromandelicAcidChloromandelicAcidChloromandelicAcidA
98ChlorothalonilChlorothalonilChlorothiazideA
99ChlorothiazideChlorothiazideChlorothiazideA
100CoroneneCoroneneCoroneneA
101CoumarinCoumarinCoumarinA
102CyanuricAcidCyanuricAcidCyanuricAcidA
103CyclopentaneCyclopentaneCyclopentaneB
104CytosineCytosineCytosineA
105DeazauracilDeazauracilDeazauracilADeazauracilBDeazauracilC
106DehydroprolineDehydroprolineDehydroprolineA
107DesloratadineDesloratadineDesloratadineA
108DiaminoDinitroPyrazineDiaminoDinitroPyrazineDiaminoDinitroPyrazineA
109DiaminoDinitroPyridineOxideDiaminoDinitroPyridineOxidePyridineA
110DibenzocycloheptenylethanoneDibenzoCycloheptenylEthanoneDibenzoCycloheptenylEthanoneA
111DibenzosuberenoneDibenzosuberenoneDibenzosuberenoneA
112DichloromethaneDichloromethaneDichloromethaneADichloromethaneB
113DiclofenacDiclofenacDiclofenacA
114DicyanobenzeneDicyanobenzeneDicyanobenzeneADicyanobenzeneBDicyanobenzeneC
115DihydrodibenzocycloheptenylethanoneDihydroDibenzoCycloheptenylEthanoneDihydroDibenzoCycloheptenylEthanoneA
116DimethylureaDimethylureaDimethylureaA
1173,4-dinitrochlorobenzeneDinitrochlorobenzene34-dinitrochlorobenzeneA
118DipicolinicAcidDipicolinicAcidDipicolinicAcidA
119EphedriniumTartrateEphedriniumTartrateEphedriniumTartrateA
120EquilinEquilinEquilinA
121EquilininEquilininEquilininA
122EstradiolEstradiolEstradiolA
1235-FluorocytosineFluorocytosine5fluorocytosineA
1242fluoroethynylbenzeneFluoroethynylbenzeneUreaA
1255-fluorouracilFluorouracilUracilA
126GallicAcidGallicAcidGallicAcidA
127GalunisertibGalunisertibGalunisertibA
128GentisicAcidGentisicAcidGentisicAcidAGentisicAcidB
129GlucoseGlucoseGlucoseA
130GSK269984BGSK269984BLY2624803A
131GuanineGuanineNitrofurantoinA
132HydrochlorothiazideHydrochlorothiazideHydrochlorothiazideA
133HydroxyazabenzotriazoleHydroxyazabenzotriazoleHydroxyazabenzotriazoleA
1344-HydroxycoumarinHydroxycoumarin4HydroxycoumarinA
1357-HydroxycoumarinHydroxycoumarin7hydroxycoumarinA
136HydroxymethyloxazolidinoneHydroxymethyloxazolidinoneHydroxymethyloxazolidinoneA
137IbuprofenIbuprofenIbuprofenA
138ImidazoleImidazoleImidazoleA
139IminodibenzylIminodibenzylIminodibenzylA
140IndomethacinIndomethacinIndomethacinA
141IsocaffeineIsocaffeineIsocaffeineA
142IsocytosineIsocytosineIsocytosineAIsocytosineB
143IsonicotinamideIsonicotinamideIsonicotinamideB
144LactideLactideLactideA
145LamotrigineLamotrigineLamotrigineA
146LY2624803LY2624803LY2624803A
147LY2806920LY2806920LY2806920ALY2806920HClA
148AlditolsMannitolMannitolASorbitolA
149MebendazoleMebendazoleAMebendazoleAAMebendazoleB
150MemantineHydrochlorideMemantineHydrochlorideMemantineHydrochlorideA
151MetacetamolMetacetamolParacetamolA
152MethanolMethanolMethanolA
1536methoxycoumarinMethoxycoumarin6methoxycoumarinA
154Methyl-p-hydroxybenzoateMethyl-p-hydroxybenzoateMethyl-p-hydroxybenzoateA
155MethylazetidineoneMethylazetidineoneAzetidineA
1566methyluracilMethyluracil6methyluracilA
157N-acetyl-iminostilbeneNAcetylDibenzazepineNAcetyldibenzazepineA
158NaphthaleneNaphthaleneNaphthaleneA
159NaproxenNaproxenNaproxenANaproxenB
160NitrofurantoinNitrofurantoinNitrofurantoinA
161NitrophenylAceticAcidNitrophenylaceticAcidNitrophenylAceticAcidA
162OroticAcidOroticAcidOroticAcidA
163OxamicAcidOxamicAcidOxamicAcidA
1643-oxauracilOxauracil3OxauracilA
165ParabanicAcidParabanicAcidParabanicAcidA
166ParacetamolParacetamolParacetamolA
167PentachloronitrobenzenePentachloronitrobenzenePentachloronitrobenzeneA
168PhenanthrenolPhenanthrenolPhenanthrenolA
169PhloroglucinolPhloroglucinolPhloroglucinolDihydrateB
170PhthalimidePhthalimideNaphthaleneA
171PiracetamPiracetamParacetamolA
172ProgesteroneProgesteroneProgesteroneAProgesteroneB
173PyrenePyrenePyreneA
174PyridinePyridinePyridineA
175PyridonePyridonePyridoneAPyridoneB
176SaccharinSaccharinSuccinicAcidD
177SalsalateSalsalateSalsalateA
178AlditolsSorbitolMannitolASorbitolA
179SuccinicAcidSuccinicAcidSuccinicAcidD
180SulfadiazineSulfadiazineSulfadiazineA
181SulfamerazineSulfamerazineSulfamerazineA
182TazofeloneTazofeloneTazofeloneA
183TetrachlorobenzeneTetrachlorobenzeneTetrachlorobenzeneA
184TetrahydrodimethylquinolineTetrahydroDimethylQuinolineTetrahydroDimethylQuinolineA
185TetrazolPyrazineTetrazolPyrazineTetrazolPyrazineA
186TetrazolPyrimidineTetrazolPyrimidineTetrazolPyrimidineA
187TetrolicAcidTetrolicAcidTetrolicAcidA
188TrifluoroethanolTrifluoroethanolTrifluoroethanolB
189TrinitrobenzeneTrinitrobenzeneTrinitrobenzeneA
1903,8,9-Trinitro-5H-dibenzo(b,d)pyran-5-oneTrinitrodibenzopyranoneTrinitrodibenzopyranoneA
191UrazoleUrazoleUrazoleA
192UreaUreaUreaA
193UricAcidUricAcidUricAcidB
No matching cases.