UCSF

ZINC09380144

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2007 38 No

Popular Name: 4-(4-butoxy-3-methyl-benzoyl)-3-hydroxy-1-(3-methoxypropyl)-5-(3,4,5-trimethoxyphenyl)-5H-pyrrol-2-o 4-(4-butoxy-3-methyl-benzoyl)-3-…

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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) 4.14 9.93 -59.49 0 9 -1 107 526.606 14 ↓
Mid Mid (pH 6-8) 3.55 1.12 -23.52 0 9 0 100 527.614 14 ↓
Mid Mid (pH 6-8) 4.58 8.94 -29.81 1 9 0 104 527.614 13 ↓

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