| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 20 | Yes |
Popular Name: (1S,2R)-1-(5-chloro-2-thienyl)-N1-[(3-fluorophenyl)methyl]-N1-methyl-propane-1,2-diamine (1S,2R)-1-(5-chloro-2-thienyl)-N…
| 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) | 3.37 | 6.43 | -41.11 | 3 | 2 | 1 | 31 | 313.849 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.37 | 8.09 | -39.11 | 3 | 2 | 1 | 30 | 313.849 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.37 | 6.21 | -2.4 | 2 | 2 | 0 | 29 | 312.841 | 5 | ↓ |
