UCSF

ZINC34830657

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 27 Yes

Popular Name: N-[[5-(4-ethylpiperazin-1-yl)-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]methyl]-2-methoxy-ethanamine N-[[5-(4-ethylpiperazin-1-yl)-1-…

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Annotations

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) 2.01 10.26 -116.68 3 6 2 51 377.508 8 ↓
Hi High (pH 8-9.5) 2.01 6.6 -5.72 1 6 0 46 375.492 8 ↓
Mid Mid (pH 6-8) 2.01 8.03 -42.73 2 6 1 50 376.5 8 ↓

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