| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 20 | Yes |
Popular Name: (1S,2R)-1-(5-bromo-2-thienyl)-N1-methyl-N1-(m-tolylmethyl)propane-1,2-diamine (1S,2R)-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) | 3.79 | 9.09 | -122.82 | 4 | 2 | 2 | 32 | 355.345 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.79 | 6.6 | -2.34 | 2 | 2 | 0 | 29 | 353.329 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.79 | 6.93 | -47.2 | 3 | 2 | 1 | 31 | 354.337 | 5 | ↓ |
