UCSF

ZINC69511684

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2011 24 Yes

Popular Name: 3-(3,5-dioxo-2H-1,2,4-triazin-6-yl)-N-[[1-(2-thienyl)cyclopentyl]methyl]propanamide 3-(3,5-dioxo-2H-1,2,4-triazin-6-…

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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) 2.02 1.68 -36.83 2 7 -1 111 347.42 6 ↓
Mid Mid (pH 6-8) 1.56 3.26 -10.7 3 7 0 108 348.428 6 ↓

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

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