UCSF

ZINC40110547

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2010 33 No

Popular Name: 4-[(2R)-4-hydroxy-1-(2-hydroxyethyl)-2-(4-nitrophenyl)-5-oxo-2H-pyrrole-3-carbonyl]-N,N-dimethyl-ben 4-[(2R)-4-hydroxy-1-(2-hydroxyet…

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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) 1.02 4.03 -55.16 1 11 -1 164 474.471 8 ↓
Lo Low (pH 4.5-6) 1.02 3.23 -20.23 2 11 0 161 475.479 8 ↓

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