UCSF

ZINC40235477

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 4th, 2010 21 Yes

Popular Name: 3-(aminomethyl)-N-ethyl-N-(m-tolyl)imidazo[1,2-a]pyridin-2-amine 3-(aminomethyl)-N-ethyl-N-(m-tol…

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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) 3.45 9.28 -99.42 4 4 2 49 282.391 4 ↓
Hi High (pH 8-9.5) 3.45 8.4 -11.84 2 4 0 47 280.375 4 ↓
Hi High (pH 8-9.5) 3.45 8.88 -25.78 3 4 1 48 281.383 4 ↓
Mid Mid (pH 6-8) 3.45 8.8 -50.03 3 4 1 48 281.383 4 ↓

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

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