| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 28th, 2010 | 16 | Yes |
Popular Name: (2S)-N1-[(3-chlorophenyl)methyl]-N1,3-dimethyl-butane-1,2-diamine (2S)-N1-[(3-chlorophenyl)methyl]…
| 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) | 2.38 | 5.21 | -40.35 | 3 | 2 | 1 | 31 | 241.786 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.38 | 6.78 | -35.45 | 3 | 2 | 1 | 30 | 241.786 | 5 | ↓ |
