UCSF

ZINC37243275

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 34 No

Popular Name: (3aS,4S,8aR,8bS)-2-(2,4-dimethoxyphenyl)-1'-ethyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrol (3aS,4S,8aR,8bS)-2-(2,4-dimethox…

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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) 2.87 8.74 -19.62 0 8 0 79 461.518 4 ↓
Mid Mid (pH 6-8) 2.87 11.2 -45.81 1 8 1 81 462.526 4 ↓

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

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