UCSF

ZINC60250217

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 17th, 2011 33 Yes

Popular Name: N-(2-dimethylaminoethyl)-4-ethoxy-N-methyl-3-(5-methyl-4-oxo-7-propyl-1H-imidazo[5,1-f][1,2,4]triazi N-(2-dimethylaminoethyl)-4-ethox…

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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) 2.32 8.33 -52 2 10 1 114 477.611 10 ↓
Hi High (pH 8-9.5) 2.78 4.08 -59.77 0 10 -1 116 475.595 10 ↓
Mid Mid (pH 6-8) 2.78 6.54 -61.14 1 10 0 117 476.603 10 ↓

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