UCSF

ZINC55413863

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 14th, 2010 22 Yes

Popular Name: (2S)-N-(imidazo[1,2-a]pyrimidin-6-ylmethyl)-N-methyl-1-(4-methyl-2-pyridyl)propan-2-amine (2S)-N-(imidazo[1,2-a]pyrimidin-…

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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) 1.91 8.78 -13.81 0 5 0 46 295.39 5 ↓
Mid Mid (pH 6-8) 1.91 9.25 -44.04 1 5 1 48 296.398 5 ↓
Lo Low (pH 4.5-6) 1.91 11.52 -120.75 2 5 2 49 297.406 5 ↓
Lo Low (pH 4.5-6) 1.91 11.06 -55.54 1 5 1 48 296.398 5 ↓

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Rings

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

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