In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2009 | 26 | Yes |
Popular Name: 2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-N-thiazol-2-yl-acetamide 2-[4-[(2,5-dimethoxyphenyl)methy…
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) | 1.90 | 5.27 | -40.43 | 2 | 7 | 1 | 68 | 377.49 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.90 | 3.13 | -17.78 | 1 | 7 | 0 | 67 | 376.482 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.72 | 4.28 | -32.19 | 1 | 7 | 0 | 74 | 376.482 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 4.69 | -33.45 | 2 | 7 | 1 | 71 | 377.49 | 6 | ↓ |