UCSF

ZINC00795046

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2004 29 No

Popular Name: (5S)-4-(2-furoyl)-3-hydroxy-5-p-phenetyl-1-[[(2S)-tetrahydrofuran-2-yl]methyl]-3-pyrrolin-2-one (5S)-4-(2-furoyl)-3-hydroxy-5-p-…

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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) 2.44 0.11 -13.9 1 7 0 89 397.427 7 ↓
Mid Mid (pH 6-8) 1.86 0.03 -21.43 0 7 0 86 397.427 7 ↓

Activity (Go SEA)

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