| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 20 | Yes |
Popular Name: (1S)-N'-(2-dimethylaminoethyl)-1-(2-methoxyphenyl)-N'-propyl-ethane-1,2-diamine (1S)-N'-(2-dimethylaminoethyl)-1…
| 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) | 0.37 | 5.7 | -100.64 | 4 | 4 | 2 | 45 | 281.444 | 9 | ↓ |
| Hi High (pH 8-9.5) | 0.37 | 4.79 | -33.47 | 3 | 4 | 1 | 43 | 280.436 | 9 | ↓ |
| Hi High (pH 8-9.5) | 0.37 | 5.36 | -35.32 | 3 | 4 | 1 | 43 | 280.436 | 9 | ↓ |
| Hi High (pH 8-9.5) | 0.37 | 3.21 | -40.32 | 3 | 4 | 1 | 43 | 280.436 | 9 | ↓ |
| Hi High (pH 8-9.5) | 0.37 | 2.59 | -3.67 | 2 | 4 | 0 | 42 | 279.428 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 0.37 | 7.54 | -226.56 | 5 | 4 | 3 | 46 | 282.452 | 9 | ↓ |
