UCSF

ZINC02782018

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 23 Yes

Popular Name: (2S)-2-(4-bromo-5-methyl-pyrazol-1-yl)-1-[4-(2-pyrimidyl)piperazino]propan-1-one (2S)-2-(4-bromo-5-methyl-pyrazol…

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Download: MOL2 SDF SMILES Flexibase

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) 1.36 -2.57 -17.4 0 7 0 67 379.262 3 ↓

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