UCSF

ZINC59672202

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 8th, 2011 30 Yes

Popular Name: N'-(2-diethylaminoethyl)-N,N-diethyl-N'-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]ethane-1,2-diamine N'-(2-diethylaminoethyl)-N,N-die…

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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) 4.31 13.86 -114.11 3 6 2 54 410.61 12 ↓
Hi High (pH 8-9.5) 4.31 11.83 -45.8 2 6 1 52 409.602 12 ↓

Activity (Go SEA)

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