UCSF

ZINC63270017

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 27th, 2011 32 No

Popular Name: (3S)-3-[(4aR)-1,3,4,4a-tetrahydropyrido[4,3-b]indol-2-yl]-1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidin (3S)-3-[(4aR)-1,3,4,4a-tetrahydr…

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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) 2.25 7.78 -39.39 1 7 1 73 434.516 6 ↓
Mid Mid (pH 6-8) 2.25 9.97 -120.97 2 7 2 74 435.524 6 ↓

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

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