| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 15 | Yes |
Popular Name: (3S)-N1-[(1S)-1,3-dimethylbutyl]-N3-ethyl-N1-methyl-butane-1,3-diamine (3S)-N1-[(1S)-1,3-dimethylbutyl]…
| 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) | 3.09 | 7.92 | -101.25 | 3 | 2 | 2 | 21 | 216.413 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.09 | 6.95 | -30.03 | 2 | 2 | 1 | 16 | 215.405 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.09 | 6.11 | -33.75 | 2 | 2 | 1 | 20 | 215.405 | 8 | ↓ |
