| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 20 | Yes |
Popular Name: (1R,2S)-1-(5-bromo-2-thienyl)-N1-[(3-chlorophenyl)methyl]-N1-methyl-propane-1,2-diamine (1R,2S)-1-(5-bromo-2-thienyl)-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) | 4.01 | 7.13 | -48.12 | 3 | 2 | 1 | 31 | 374.755 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.01 | 8.6 | -40.76 | 3 | 2 | 1 | 30 | 374.755 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.01 | 6.41 | -2.49 | 2 | 2 | 0 | 29 | 373.747 | 5 | ↓ |
