UCSF

ZINC49424461

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 28th, 2010 19 Yes

Popular Name: 2-propoxy-N-[5-(2-pyridyl)-4H-1,2,4-triazol-3-yl]acetamide 2-propoxy-N-[5-(2-pyridyl)-4H-1,…

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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) 0.90 5.41 -12.19 2 7 0 96 261.285 5 ↓
Hi High (pH 8-9.5) 0.72 5.83 -57.89 1 7 -1 91 260.277 6 ↓
Hi High (pH 8-9.5) 0.91 3.6 -53.74 1 7 -1 99 260.277 6 ↓

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

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