UCSF

ZINC16248111

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2008 33 No

Popular Name: (5S)-1-(3-dimethylaminopropyl)-4-(3-fluoro-4-methoxy-benzoyl)-3-hydroxy-5-(3-nitrophenyl)-5H-pyrrol- (5S)-1-(3-dimethylaminopropyl)-4…

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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) 2.76 10.26 -73.61 1 9 0 120 457.458 9 ↓
Mid Mid (pH 6-8) 3.21 9.11 -66.79 2 9 1 117 458.466 8 ↓
Mid Mid (pH 6-8) 2.18 10.13 -66.76 1 9 1 114 458.466 9 ↓

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