UCSF

ZINC37084053

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2009 21 Yes

Popular Name: (1R)-N-cyclopentyl-N-methyl-1-(1-phenylpyrazol-4-yl)ethane-1,2-diamine (1R)-N-cyclopentyl-N-methyl-1-(1…

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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) 1.78 6.32 -44.71 3 4 1 49 285.415 5 ↓
Lo Low (pH 4.5-6) 1.78 7.57 -132.57 4 4 2 50 286.423 5 ↓

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