UCSF

ZINC37201991

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 19 Yes

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

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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) 2.10 7.95 -74.28 3 4 2 35 262.401 7 ↓
Hi High (pH 8-9.5) 2.10 5.35 -8.18 1 4 0 33 260.385 7 ↓
Mid Mid (pH 6-8) 2.10 7.5 -41.36 2 4 1 34 261.393 7 ↓
Lo Low (pH 4.5-6) 2.10 8.86 -126.97 3 4 2 38 262.401 7 ↓

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Rings

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