In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 34 | Yes |
Popular Name: N-(6-chloro-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-2-phenyl-quinoline-4-carboxamide N-(6-chloro-1,3-benzothiazol-2-y…
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) | 6.44 | 15.32 | -45.68 | 1 | 5 | 1 | 51 | 488.036 | 6 | ↓ |
Hi High (pH 8-9.5) | 6.44 | 12.89 | -10.02 | 0 | 5 | 0 | 49 | 487.028 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.