In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 20 | Yes |
Popular Name: (1S)-N-ethyl-N'-(1-ethylpropyl)-1-(4-methoxyphenyl)-N'-methyl-ethane-1,2-diamine (1S)-N-ethyl-N'-(1-ethylpropyl)-…
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) | 3.89 | 9.01 | -113.13 | 3 | 3 | 2 | 30 | 280.456 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.89 | 7.81 | -31.97 | 2 | 3 | 1 | 26 | 279.448 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.89 | 7.76 | -34.54 | 2 | 3 | 1 | 29 | 279.448 | 9 | ↓ |