UCSF

ZINC42456010

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2010 17 Yes

Popular Name: (2S)-N'-(imidazo[1,2-a]pyridin-2-ylmethyl)-N',2-dimethyl-propane-1,3-diamine (2S)-N'-(imidazo[1,2-a]pyridin-2…

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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) 0.89 5.06 -79.53 4 4 2 49 234.347 5 ↓
Hi High (pH 8-9.5) 0.89 3.95 -9.23 2 4 0 47 232.331 5 ↓
Hi High (pH 8-9.5) 0.89 5.99 -36.6 3 4 1 48 233.339 5 ↓
Mid Mid (pH 6-8) 0.89 4.32 -48.46 3 4 1 48 233.339 5 ↓
Lo Low (pH 4.5-6) 0.89 6.36 -104.83 4 4 2 49 234.347 5 ↓

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