UCSF

ZINC58331417

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 25 Yes

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

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Vendors

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) 0.97 7.26 -19.04 2 9 0 122 336.311 3 ↓
Mid Mid (pH 6-8) 0.98 6.44 -59.34 1 9 -1 125 335.303 4 ↓
Mid Mid (pH 6-8) 0.79 7.79 -22.47 2 9 0 119 336.311 4 ↓
Lo Low (pH 4.5-6) 0.79 7.8 -24.41 2 9 0 119 336.311 4 ↓

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

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