UCSF

ZINC01121736

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2004 34 No

Popular Name: (5S)-5-(4-benzoxyphenyl)-4-(2-furoyl)-3-hydroxy-1-[[(2R)-tetrahydrofuran-2-yl]methyl]-3-pyrrolin-2-o (5S)-5-(4-benzoxyphenyl)-4-(2-fu…

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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) 3.66 9.24 -16.92 1 7 0 89 459.498 8 ↓
Mid Mid (pH 6-8) 3.08 9.93 -24.82 0 7 0 86 459.498 8 ↓

Activity (Go SEA)

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