UCSF

ZINC09506867

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 29th, 2007 31 No

Popular Name: 1-(6-ethylbenzothiazol-2-yl)-3-hydroxy-5-(5-methyl-2-furyl)-4-(2-thienylcarbonyl)-5H-pyrrol-2-one 1-(6-ethylbenzothiazol-2-yl)-3-h…

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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) 4.90 10.88 -58.75 0 6 -1 86 449.533 5 ↓
Mid Mid (pH 6-8) 5.35 9.85 -28.46 1 6 0 84 450.541 4 ↓
Mid Mid (pH 6-8) 4.32 10.89 -16.09 0 6 0 80 450.541 5 ↓

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