UCSF

ZINC36998856

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2009 15 Yes

Popular Name: (4aS,5aS,9aS,10R,10aS)-10-methyl-1,2,3,4,4a,5,5a,6,7,8,9,9a,10,10a-tetradecahydrobenzo[b][1,6]naphth (4aS,5aS,9aS,10R,10aS)-10-methyl…

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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) 2.40 4.72 -105.3 4 2 2 33 210.365 0 ↓
Hi High (pH 8-9.5) 2.40 3.56 -38.36 3 2 1 29 209.357 0 ↓

Activity (Go SEA)

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