UCSF

ZINC20264476

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 35 No

Popular Name: (5S)-5-(3-allyloxyphenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5H-pyrrol-2-one (5S)-5-(3-allyloxyphenyl)-4-(4-f…

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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) 3.37 8.67 -55.29 0 7 -1 82 479.528 10 ↓
Mid Mid (pH 6-8) 3.37 11 -73.31 1 7 0 83 480.536 10 ↓
Lo Low (pH 4.5-6) 3.37 10.18 -54.52 2 7 1 81 481.544 10 ↓

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