| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 21 | Yes |
Popular Name: (1S,2S)-1-(4-chlorophenyl)-N1-[(5-chloro-2-thienyl)methyl]-N1-methyl-butane-1,2-diamine (1S,2S)-1-(4-chlorophenyl)-N1-[(…
| 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) | 4.44 | 8.17 | -49.85 | 3 | 2 | 1 | 31 | 344.331 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.44 | 9.66 | -132.22 | 4 | 2 | 2 | 32 | 345.339 | 6 | ↓ |
