UCSF

ZINC33906203

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 31st, 2009 22 No

Popular Name: 2-Butanone, 4-(1,3,4,4a,5,6,11,11a-octahydro-2H-pyrido(4,3-b)carbazol-2-yl)-, trans-; 4a,11a-trans-2-gamma-Ketobutyl-1,2,3,4,4a,5,11,11a-octahydro-6H-pyrido(4,3-b)carbazole; LS-46855; trans-4-(1,3,4,4a,5,6,11,11a-Octahydro-2H-pyrido(4,3-b)carbazol-2-yl)-2 2-Butanone, 4-(1,3,4,4a,5,6,11,1…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.27 10.39 -46.62 2 3 1 37 297.422 3 ↓
Hi High (pH 8-9.5) 3.27 8.12 -9.54 1 3 0 36 296.414 3 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )