UCSF

ZINC49543262

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 30 Yes

Popular Name: (7S)-1-(2,5-dimethoxyphenyl)-7-(3-hydroxyphenyl)-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) 2.88 3.73 -70.26 2 8 -1 116 407.402 5 ↓
Ref Reference (pH 7) 2.70 6.39 -62.61 2 8 -1 113 407.402 5 ↓
Lo Low (pH 4.5-6) 2.88 4.8 -49.54 3 8 0 118 408.41 5 ↓

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

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