UCSF

ZINC38570607

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 31 No

Popular Name: (5R,6S)-5-[(1S,9aS)-2-methyl-1,3,4,9a-tetrahydropyrido[3,4-b]indol-1-yl]-1-(4-chlorophenyl)-6-hydrox (5R,6S)-5-[(1S,9aS)-2-methyl-1,3…

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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) 3.55 7.55 -10.18 2 7 0 80 438.915 2 ↓
Mid Mid (pH 6-8) 3.55 9.09 -46.23 3 7 1 81 439.923 2 ↓

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

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