In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2008 | 22 | Yes |
Popular Name: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide 2-[4-(2-hydroxyethyl)piperazin-1…
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) | 1.07 | 0.37 | -11.4 | 2 | 6 | 0 | 69 | 324.45 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.07 | 2.77 | -47.64 | 3 | 6 | 1 | 70 | 325.458 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.88 | 1.7 | -35.97 | 2 | 6 | 0 | 76 | 324.45 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.07 | 2.72 | -39.24 | 3 | 6 | 1 | 70 | 325.458 | 5 | ↓ |