In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 20 | Yes |
Popular Name: (4-methylpiperazin-1-yl)-[4-methyl-2-(3-thienyl)thiazol-5-yl]methanone (4-methylpiperazin-1-yl)-[4-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) | 2.17 | 4.36 | -9.79 | 0 | 4 | 0 | 36 | 307.444 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.17 | 6.71 | -48.03 | 1 | 4 | 1 | 38 | 308.452 | 2 | ↓ |