UCSF

ZINC21537444

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2008 33 Yes

Popular Name: N-(1H-benzimidazol-2-ylmethyl)-2-[[2-(4-methoxyphenyl)-7-oxo-6H-pyrazolo[5,1-f][1,3,5]triazin-4-yl]s N-(1H-benzimidazol-2-ylmethyl)-2…

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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) 2.50 7.07 -20.77 3 10 0 130 461.507 7 ↓
Lo Low (pH 4.5-6) 2.96 5.26 -49.75 4 10 1 132 462.515 7 ↓
Lo Low (pH 4.5-6) 2.50 7.91 -54.37 4 10 1 131 462.515 7 ↓

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

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