UCSF

ZINC02738479

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 18 No

Popular Name: (1-methyl-4-nitro-pyrazol-3-yl)-[(2S)-2-methylpiperidino]methanone (1-methyl-4-nitro-pyrazol-3-yl)-…

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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) 1.19 1.53 -15.85 0 7 0 83 252.274 2 ↓

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