UCSF

ZINC58517877

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 8th, 2011 25 Yes

Popular Name: N,N-diethyl-2-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)-1,4-diazepan-1-yl]acetamide N,N-diethyl-2-[4-(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) 1.61 9.69 -81.55 2 6 2 47 345.491 6 ↓
Hi High (pH 8-9.5) 1.61 7.68 -16.94 0 6 0 44 343.475 6 ↓
Mid Mid (pH 6-8) 1.61 9.67 -43.17 1 6 1 45 344.483 6 ↓

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

No pre-computed analogs available. Try a structural similarity search.