UCSF

ZINC37188679

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 21 Yes

Popular Name: N',N'-diisopropyl-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]ethane-1,2-diamine N',N'-diisopropyl-N-[(2-methylim…

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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) 2.70 8.62 -72.37 3 4 2 35 290.455 7 ↓
Hi High (pH 8-9.5) 2.70 6.1 -8.07 1 4 0 33 288.439 7 ↓
Mid Mid (pH 6-8) 2.70 8.17 -39.53 2 4 1 34 289.447 7 ↓
Lo Low (pH 4.5-6) 2.70 9.52 -124.63 3 4 2 38 290.455 7 ↓

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