UCSF

ZINC43895563

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2010 20 Yes

Popular Name: (1S)-1-(2,4-dimethylphenyl)-N'-[(1S)-1,2-dimethylpropyl]-N-ethyl-N'-methyl-ethane-1,2-diamine (1S)-1-(2,4-dimethylphenyl)-N'-[…

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Vendors

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) 4.36 10.87 -115.63 3 2 2 21 278.484 7 ↓
Mid Mid (pH 6-8) 4.36 9.92 -31.46 2 2 1 16 277.476 7 ↓
Mid Mid (pH 6-8) 4.36 9.44 -32.58 2 2 1 20 277.476 7 ↓

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