UCSF

ZINC41584609

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 32 No

Popular Name: (2Z)-2-[(2-chlorophenyl)methylene]-6-hydroxy-7-[[(2S)-2-(3-pyridyl)-1-piperidyl]methyl]benzofuran-3- (2Z)-2-[(2-chlorophenyl)methylen…

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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) 4.81 11.61 -43.76 2 5 1 68 447.942 4 ↓
Hi High (pH 8-9.5) 4.81 10.11 -45.62 0 5 -1 69 445.926 4 ↓
Mid Mid (pH 6-8) 4.81 9.35 -9.12 1 5 0 67 446.934 4 ↓
Mid Mid (pH 6-8) 4.81 12.37 -36.29 1 5 0 71 446.934 4 ↓

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