| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 16 | Yes |
Popular Name: (3S)-N1-butyl-N1-cyclopropyl-N3-propyl-butane-1,3-diamine (3S)-N1-butyl-N1-cyclopropyl-N3-…
| 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) | 3.41 | 9.21 | -102.35 | 3 | 2 | 2 | 21 | 228.424 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.41 | 6.92 | -35.66 | 2 | 2 | 1 | 20 | 227.416 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.41 | 8.02 | -31.93 | 2 | 2 | 1 | 16 | 227.416 | 10 | ↓ |
