UCSF

ZINC49543164

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 31 Yes

Popular Name: (7S)-1-(2,5-dimethoxyphenyl)-7-(3-methoxyphenyl)-5-oxo-6,7-dihydro-4H-pyrrolo[3,2-b]pyridine-3-carbo (7S)-1-(2,5-dimethoxyphenyl)-7-(…

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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) 3.42 5.72 -68.94 1 8 -1 105 421.429 6 ↓
Ref Reference (pH 7) 3.23 8.41 -61.25 1 8 -1 102 421.429 6 ↓
Lo Low (pH 4.5-6) 3.42 6.8 -47.78 2 8 0 107 422.437 6 ↓

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

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