UCSF

ZINC31561090

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2009 27 Yes

Popular Name: 4-Amino-5-chloro-2-methoxy-N-(2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)benzamide; BRN 0845305; Benzamide, 4-amino-5-chloro-2-methoxy-N-(2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)-; LS-25457 4-Amino-5-chloro-2-methoxy-N-(2-…

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Vendors

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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) 2.47 5.43 -36.52 4 7 1 85 390.895 6 ↓
Mid Mid (pH 6-8) 2.47 5.12 -13.49 3 7 0 84 389.887 6 ↓
Lo Low (pH 4.5-6) 2.47 7.65 -101.16 5 7 2 86 391.903 6 ↓
Lo Low (pH 4.5-6) 2.47 7.34 -48.27 4 7 1 85 390.895 6 ↓

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