UCSF

ZINC38571027

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 31 Yes

Popular Name: 2-[(3R,4S)-6-chloro-7-hydroxy-4-methyl-2-oxo-chroman-3-yl]-N-[2-(5-methoxy-2H-indol-3-yl)ethyl]aceta 2-[(3R,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) 3.70 7.01 -22.17 3 7 0 101 442.899 6 ↓
Hi High (pH 8-9.5) 3.70 7.76 -55.28 2 7 -1 103 441.891 6 ↓

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

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