In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 25th, 2009 | 21 | Yes |
Popular Name: N-(1,3-benzothiazol-2-yl)-3,5-dibromo-2-hydroxy-benzamide N-(1,3-benzothiazol-2-yl)-3,5-di…
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) | 5.19 | 6.99 | -10.12 | 2 | 4 | 0 | 62 | 428.105 | 2 | ↓ |
Hi High (pH 8-9.5) | 4.71 | 7.05 | -110.33 | 0 | 4 | -2 | 71 | 426.089 | 2 | ↓ |
Mid Mid (pH 6-8) | 5.19 | 7.99 | -43.56 | 1 | 4 | -1 | 65 | 427.097 | 2 | ↓ |