UCSF

ZINC65507537

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 21 Yes

Popular Name: 5-ethyl-2-methyl-N-[(8-methylimidazo[1,2-a]pyridin-3-yl)methyl]pyrimidin-4-amine 5-ethyl-2-methyl-N-[(8-methylimi…

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Download: MOL2 SDF SMILES Flexibase

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) 2.38 9.28 -31.52 2 5 1 56 282.371 4 ↓
Mid Mid (pH 6-8) 2.38 9.22 -35.74 2 5 1 56 282.371 4 ↓
Mid Mid (pH 6-8) 2.38 8.79 -9.6 1 5 0 55 281.363 4 ↓
Mid Mid (pH 6-8) 2.38 9.72 -73.24 3 5 2 58 283.379 4 ↓

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Rings

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

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