UCSF

ZINC40024501

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 21st, 2010 33 Yes

Popular Name: N-[(1-methylbenzimidazol-2-yl)methyl]-1-[3-(trifluoromethyl)-[1,2,4]triazolo[3,4-f]pyridazin-6-yl]pi N-[(1-methylbenzimidazol-2-yl)me…

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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) 2.42 10.04 -25.13 1 9 0 93 458.448 5 ↓
Mid Mid (pH 6-8) 2.42 10.47 -50.84 2 9 1 94 459.456 5 ↓

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

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