| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 17 | Yes |
Popular Name: (3S)-N1-(2-dimethylaminoethyl)-N1,N3-dipropyl-butane-1,3-diamine (3S)-N1-(2-dimethylaminoethyl)-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) | 2.52 | 6.92 | -92.04 | 3 | 3 | 2 | 24 | 245.455 | 11 | ↓ |
| Hi High (pH 8-9.5) | 2.52 | 6.54 | -105.03 | 3 | 3 | 2 | 24 | 245.455 | 11 | ↓ |
| Hi High (pH 8-9.5) | 2.52 | 7.94 | -103.92 | 3 | 3 | 2 | 21 | 245.455 | 11 | ↓ |
| Hi High (pH 8-9.5) | 2.52 | 4.47 | -35.48 | 2 | 3 | 1 | 23 | 244.447 | 11 | ↓ |
