In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 18 | Yes |
Popular Name: (1S)-1-(3,4-dimethylphenyl)-N'-[(1S)-1,2-dimethylpropyl]-N'-methyl-ethane-1,2-diamine (1S)-1-(3,4-dimethylphenyl)-N'-[…
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) | 1.73 | 7.92 | -30.32 | 3 | 2 | 1 | 30 | 249.422 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.73 | 8.3 | -123.62 | 4 | 2 | 2 | 32 | 250.43 | 5 | ↓ |