UCSF

ZINC37230062

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 22 Yes

Popular Name: (3S,3aR,8aS,9aR)-5,8a-dimethyl-3-(pyrrolidin-1-ylmethyl)-3,3a,7,8,9,9a-hexahydrobenzo[f]benzofuran-2 (3S,3aR,8aS,9aR)-5,8a-dimethyl-3…

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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) 2.71 11.26 -41.69 1 3 1 31 302.438 2 ↓
Hi High (pH 8-9.5) 2.71 8.84 -9.09 0 3 0 30 301.43 2 ↓

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

No pre-computed analogs available. Try a structural similarity search.