UCSF

ZINC23359410

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2008 36 Yes

Popular Name: 2-[4-[[5-[(3-fluorophenyl)methyl]-6-oxo-[1,3]dioxolo[4,5-g]quinolin-7-yl]methyl]piperazin-1-yl]-N-is 2-[4-[[5-[(3-fluorophenyl)methyl…

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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) 3.18 9.11 -47.62 2 8 1 77 495.575 7 ↓
Mid Mid (pH 6-8) 3.18 6.93 -18.24 1 8 0 76 494.567 7 ↓
Mid Mid (pH 6-8) 3.18 9.19 -45.06 2 8 1 77 495.575 7 ↓

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