UCSF

ZINC49543123

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 33 Yes

Popular Name: (7S)-1-(2,4-dimethoxyphenyl)-7-(2,5-dimethoxyphenyl)-5-oxo-6,7-dihydro-4H-pyrrolo[3,2-b]pyridine-3-c (7S)-1-(2,4-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) 3.22 5.33 -73.47 1 9 -1 115 451.455 7 ↓
Ref Reference (pH 7) 3.03 7.97 -65.79 1 9 -1 111 451.455 7 ↓
Lo Low (pH 4.5-6) 3.22 6.4 -47.82 2 9 0 116 452.463 7 ↓

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

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