| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 21 | Yes |
Popular Name: (1S,2R)-1-(4-chlorophenyl)-N1-(2-methoxyethyl)-N1-[(1R)-1-methylpropyl]butane-1,2-diamine (1S,2R)-1-(4-chlorophenyl)-N1-(2…
| 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) | 3.54 | 6.82 | -109.69 | 4 | 3 | 2 | 41 | 314.901 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.54 | 5.63 | -44.05 | 3 | 3 | 1 | 40 | 313.893 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.54 | 6.65 | -30.03 | 3 | 3 | 1 | 40 | 313.893 | 9 | ↓ |
