UCSF

ZINC69994164

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 20 Yes

Popular Name: N-[[1-(1-ethylpropyl)pyrazol-3-yl]methyl]-2-(4-methyl-1,2,4-triazol-3-yl)ethanamine N-[[1-(1-ethylpropyl)pyrazol-3-y…

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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) 1.36 7.39 -15.75 1 6 0 61 276.388 8 ↓
Lo Low (pH 4.5-6) 1.36 8.76 -51.23 2 6 1 65 277.396 8 ↓

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

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