UCSF

ZINC58331238

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Substance Information

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

Popular Name: 3-methyl-4-oxo-N-[5-(2-pyridyl)-4H-1,2,4-triazol-3-yl]-6,7-dihydro-5H-benzofuran-2-carboxamide 3-methyl-4-oxo-N-[5-(2-pyridyl)-…

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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) 1.48 7.73 -19.02 2 8 0 114 337.339 3 ↓
Mid Mid (pH 6-8) 1.55 6.16 -62 1 8 -1 120 336.331 3 ↓

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

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