| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 19th, 2010 | 25 | No |
Popular Name: 4-[(3-bromophenyl)methyl]-N-(2,5-dimethylphenyl)piperazine-1-carbothioamide 4-[(3-bromophenyl)methyl]-N-(2,5…
| 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) | 4.49 | 11.43 | -12.86 | 1 | 3 | 0 | 19 | 418.404 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.49 | 13.65 | -59.2 | 2 | 3 | 1 | 20 | 419.412 | 5 | ↓ |
