In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2007 | 36 | Yes |
Popular Name: N-(4,5-dimethylbenzothiazol-2-yl)-N-(2-pyridylmethyl)-2-(2-thienyl)quinoline-4-carboxamide N-(4,5-dimethylbenzothiazol-2-yl…
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) | 6.57 | -0.74 | -17.99 | 0 | 5 | 0 | 58 | 506.656 | 5 | ↓ |
Lo Low (pH 4.5-6) | 6.57 | -0.41 | -39.32 | 1 | 5 | 1 | 60 | 507.664 | 5 | ↓ |