| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 21 | Yes |
Popular Name: (1R,2S)-1-(4-chlorophenyl)-N1-methyl-N1-[(1S)-1-(2-thienyl)ethyl]butane-1,2-diamine (1R,2S)-1-(4-chlorophenyl)-N1-me…
| 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) | 4.20 | 9.02 | -118.42 | 4 | 2 | 2 | 32 | 324.921 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.20 | 7.1 | -47.98 | 3 | 2 | 1 | 31 | 323.913 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.20 | 8.72 | -35.83 | 3 | 2 | 1 | 30 | 323.913 | 6 | ↓ |
