UCSF

ZINC33701121

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 16th, 2009 35 Yes

Popular Name: (2S,3S,11bS)-3-ethyl-9,10-dimethoxy-2-[[(1R)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]methyl]-2 (2S,3S,11bS)-3-ethyl-9,10-dimeth…

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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) 5.26 11.06 -132.39 5 6 2 76 477.649 5 ↓
Hi High (pH 8-9.5) 5.26 10.71 -61.45 3 6 0 74 475.633 5 ↓
Mid Mid (pH 6-8) 5.26 9.79 -51.92 4 6 1 71 476.641 5 ↓

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