UCSF

ZINC09506778

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 29th, 2007 34 No

Popular Name: 5-(2-fluorophenyl)-3-hydroxy-4-(3-methoxybenzoyl)-1-(6-methylbenzothiazol-2-yl)-5H-pyrrol-2-one 5-(2-fluorophenyl)-3-hydroxy-4-(…

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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) 5.21 11.54 -58.93 0 6 -1 83 473.505 5 ↓
Mid Mid (pH 6-8) 5.65 10.46 -24.84 1 6 0 80 474.513 4 ↓
Mid Mid (pH 6-8) 4.62 11.51 -15.27 0 6 0 77 474.513 5 ↓

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