| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 17 | Yes |
Popular Name: (3S)-N1-isopropyl-N1-pentyl-N3-propyl-butane-1,3-diamine (3S)-N1-isopropyl-N1-pentyl-N3-p…
| 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) | 4.22 | 9.48 | -103.1 | 3 | 2 | 2 | 21 | 244.467 | 11 | ↓ |
| Hi High (pH 8-9.5) | 4.22 | 7.54 | -34.56 | 2 | 2 | 1 | 20 | 243.459 | 11 | ↓ |
| Hi High (pH 8-9.5) | 4.22 | 8.27 | -32.67 | 2 | 2 | 1 | 16 | 243.459 | 11 | ↓ |
