| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 16 | Yes |
Popular Name: (3S)-N1-methyl-N3-propyl-N1-[(1S)-1,2,2-trimethylpropyl]butane-1,3-diamine (3S)-N1-methyl-N3-propyl-N1-[(1S…
| 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) | 3.64 | 8.27 | -102.2 | 3 | 2 | 2 | 21 | 230.44 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.64 | 6.64 | -34.79 | 2 | 2 | 1 | 20 | 229.432 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.64 | 7.24 | -28.72 | 2 | 2 | 1 | 16 | 229.432 | 8 | ↓ |
