UCSF

ZINC09471120

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 27th, 2007 33 No

Popular Name: 3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-5-(4-hydroxy-3-methoxy-phenyl)-4-(4-nitrobenzoyl)-5H-pyrrol-2 3-hydroxy-1-[2-(2-hydroxyethoxy)…

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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) 0.93 3.18 -63.69 2 11 -1 165 457.415 10 ↓
Mid Mid (pH 6-8) 0.35 3.13 -31.54 2 11 0 159 458.423 10 ↓
Mid Mid (pH 6-8) 1.38 2.13 -38.87 3 11 0 162 458.423 9 ↓

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