UCSF

ZINC42443689

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2010 18 Yes

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

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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) 1.27 5.96 -84.23 4 4 2 49 248.374 6 ↓
Hi High (pH 8-9.5) 1.27 6.66 -34.63 3 4 1 48 247.366 6 ↓
Mid Mid (pH 6-8) 1.27 5.18 -46.64 3 4 1 48 247.366 6 ↓
Lo Low (pH 4.5-6) 1.27 7.04 -103.55 4 4 2 49 248.374 6 ↓

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Rings

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