UCSF

ZINC41585680

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 35 No

Popular Name: (2Z)-2-[(4-chlorophenyl)methylene]-6-hydroxy-7-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-4-methyl- (2Z)-2-[(4-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) 5.63 11.9 -51.56 2 6 1 67 491.995 5 ↓
Hi High (pH 8-9.5) 5.63 10.47 -42.1 0 6 -1 69 489.979 5 ↓
Mid Mid (pH 6-8) 5.63 12.66 -31 1 6 0 70 490.987 5 ↓
Mid Mid (pH 6-8) 5.63 9.71 -10.1 1 6 0 66 490.987 5 ↓

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