UCSF

ZINC49362777

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2010 27 Yes

Popular Name: 1-(1-isopropyl-4-piperidyl)-N-(3-methoxypropyl)-5-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide 1-(1-isopropyl-4-piperidyl)-N-(3…

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Download: MOL2 SDF SMILES Flexibase

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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) 2.21 6.91 -48.51 2 6 1 61 391.458 8 ↓
Hi High (pH 8-9.5) 2.21 4.71 -11.54 1 6 0 59 390.45 8 ↓

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

No pre-computed analogs available. Try a structural similarity search.