In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 31st, 2006 | 26 | No |
Popular Name: 2-(4-benzylpiperazin-1-yl)-5-(3-pyridylmethylene)thiazol-4-one 2-(4-benzylpiperazin-1-yl)-5-(3-…
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) | 2.32 | 9.55 | -57.15 | 1 | 5 | 1 | 51 | 365.482 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.32 | 9.83 | -93.16 | 2 | 5 | 2 | 52 | 366.49 | 4 | ↓ |