| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 15 | Yes |
Popular Name: (3S)-N3-butyl-N3-[(1S)-1-methylpropyl]pentane-1,3-diamine (3S)-N3-butyl-N3-[(1S)-1-methylp…
| 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) | 2.93 | 5.88 | -104.11 | 4 | 2 | 2 | 32 | 216.413 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.93 | 5.49 | -29.4 | 3 | 2 | 1 | 30 | 215.405 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.93 | 3.65 | -40.71 | 3 | 2 | 1 | 31 | 215.405 | 9 | ↓ |
