UCSF

ZINC29473942

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2009 54 No

Popular Name: 7-[4-[[4-[[4-(3-carboxy-1-ethyl-6-fluoro-4-oxo-7-quinolyl)piperazin-1-yl]methyl]phenyl]methyl]pipera 7-[4-[[4-[[4-(3-carboxy-1-ethyl-…

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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) 0.67 22.03 -173.81 1 12 -1 138 739.8 10 ↓
Mid Mid (pH 6-8) 0.67 20.03 -125.66 2 12 0 136 740.808 10 ↓
Mid Mid (pH 6-8) 0.67 20.02 -123.48 2 12 0 136 740.808 10 ↓
Mid Mid (pH 6-8) 0.67 19.81 -136.21 0 12 -2 137 738.792 10 ↓
Lo Low (pH 4.5-6) 0.67 20.21 -143.78 4 12 2 134 742.824 10 ↓
Lo Low (pH 4.5-6) -2.08 20.21 -172.27 4 12 2 140 742.824 9 ↓

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