UCSF

ZINC20237897

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 34 Yes

Popular Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-3-(2-fluorophenyl)-1-methyl-thieno[4,5-d]pyrazole-5-carboxamide N-[2-(4-benzylpiperazin-1-yl)eth…

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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) 4.00 10.65 -54.32 2 6 1 55 478.617 7 ↓
Mid Mid (pH 6-8) 4.00 10.71 -51.52 2 6 1 55 478.617 7 ↓
Mid Mid (pH 6-8) 4.00 8.33 -15.81 1 6 0 53 477.609 7 ↓

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