UCSF

ZINC38570046

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 29 Yes

Popular Name: 2-[(3S,4S)-6-chloro-7-hydroxy-4-methyl-2-oxo-chroman-3-yl]-N-[2-(2H-indol-3-yl)ethyl]acetamide 2-[(3S,4S)-6-chloro-7-hydroxy-4-…

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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) 3.66 7.95 -23.01 3 6 0 91 412.873 5 ↓
Hi High (pH 8-9.5) 3.66 8.71 -56.32 2 6 -1 94 411.865 5 ↓

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

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