| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 19 | Yes |
Popular Name: 2-(2-amino-4-methyl-phenyl)sulfanyl-1-(4-methylpiperazin-1-yl)ethanone 2-(2-amino-4-methyl-phenyl)sulfa…
| 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) | 1.47 | 4.05 | -9.54 | 2 | 4 | 0 | 50 | 279.409 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.47 | 6.4 | -48 | 3 | 4 | 1 | 51 | 280.417 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
