In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2008 | 22 | Yes |
Popular Name: N-(1,3-benzothiazol-2-yl)-2-(4-propylpiperazin-1-yl)acetamide N-(1,3-benzothiazol-2-yl)-2-(4-p…
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) | 2.84 | 6.96 | -43.77 | 2 | 5 | 1 | 50 | 319.454 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.84 | 6.88 | -46.93 | 2 | 5 | 1 | 50 | 319.454 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.84 | 4.68 | -14.86 | 1 | 5 | 0 | 48 | 318.446 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.66 | 6.07 | -38.17 | 1 | 5 | 0 | 56 | 318.446 | 5 | ↓ |