In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 20 | Yes |
Popular Name: (1S)-N-ethyl-N'-(1-ethylpropyl)-1-(2-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) | 3.84 | 8.99 | -108.32 | 3 | 3 | 2 | 30 | 280.456 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.84 | 8.21 | -30.68 | 2 | 3 | 1 | 26 | 279.448 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.84 | 7.56 | -31.17 | 2 | 3 | 1 | 29 | 279.448 | 9 | ↓ |