UCSF

ZINC58341920

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 24 Yes

Popular Name: 3-(2-methylbenzimidazol-1-yl)-N-(pyrazolo[1,5-a]pyrimidin-6-ylmethyl)propan-1-amine 3-(2-methylbenzimidazol-1-yl)-N-…

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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) 1.66 9.29 -73.01 2 6 1 65 321.408 6 ↓
Mid Mid (pH 6-8) 1.66 9.73 -115.68 3 6 2 66 322.416 6 ↓
Mid Mid (pH 6-8) 1.66 7.94 -18.14 1 6 0 60 320.4 6 ↓

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

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