In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2011 | 15 | Yes |
Popular Name: (4-methylpiperazin-1-yl)-(2-methylthiazol-4-yl)methanone (4-methylpiperazin-1-yl)-(2-meth…
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) | 0.15 | 2.39 | -8.98 | 0 | 4 | 0 | 36 | 225.317 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.15 | 4.76 | -39.65 | 1 | 4 | 1 | 38 | 226.325 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.