UCSF

ZINC20263726

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 36 No

Popular Name: (5S)-4-(benzofuran-2-carbonyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-morpholinoethyl)-5H-pyrrol-2-o (5S)-4-(benzofuran-2-carbonyl)-5…

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Download: MOL2 SDF SMILES Flexibase

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) 2.47 7.32 -61.62 0 9 -1 105 491.52 8 ↓
Mid Mid (pH 6-8) 2.47 9.66 -79.96 1 9 0 106 492.528 8 ↓
Lo Low (pH 4.5-6) 2.47 8.7 -59.9 2 9 1 103 493.536 8 ↓

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