UCSF

ZINC18973445

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2008 28 Yes

Popular Name: N-(4,5-dimethyl-1-oxo-2H-furo[4,3-d]pyridazin-7-yl)-2-[[5-(2-furyl)-4-methyl-1,2,4-triazol-3-yl]sulf N-(4,5-dimethyl-1-oxo-2H-furo[4,…

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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) 1.17 5.55 -20.23 2 10 0 132 400.42 5 ↓
Mid Mid (pH 6-8) 1.63 3.9 -59.29 1 10 -1 135 399.412 5 ↓
Mid Mid (pH 6-8) 1.36 2.7 -26.32 2 10 0 135 400.42 5 ↓

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

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