UCSF

ZINC52830899

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 13 Yes

Popular Name: N-(4H-1,2,4-triazol-3-ylmethyl)pyridazin-3-amine N-(4H-1,2,4-triazol-3-ylmethyl)p…

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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) -0.85 2.39 -32.62 3 6 1 81 177.191 3 ↓
Mid Mid (pH 6-8) -0.85 2.36 -39.94 3 6 1 81 177.191 3 ↓
Mid Mid (pH 6-8) -0.85 2.21 -13.55 2 6 0 79 176.183 3 ↓

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

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