UCSF

ZINC16212814

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2008 35 No

Popular Name: (5R)-5-(4-butoxyphenyl)-1-(3-dimethylaminopropyl)-3-hydroxy-4-(4-methoxy-3-methyl-benzoyl)-5H-pyrrol (5R)-5-(4-butoxyphenyl)-1-(3-dim…

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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) 4.61 12.46 -78.83 1 7 0 83 480.605 12 ↓
Mid Mid (pH 6-8) 5.05 11.33 -61.34 2 7 1 81 481.613 11 ↓
Mid Mid (pH 6-8) 4.02 12.3 -64.92 1 7 1 77 481.613 12 ↓

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