In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 11th, 2006 | 29 | Yes |
Popular Name: 2-(3,5-dimethylphenyl)amino-N-(3-pyridylmethyl)quinoline-4-carboxamide 2-(3,5-dimethylphenyl)amino-N-(3…
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) | 4.76 | 9 | -11.25 | 2 | 5 | 0 | 70 | 382.467 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.69 | 11.05 | -47.8 | 3 | 5 | 1 | 68 | 383.475 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.76 | 9.14 | -47.78 | 3 | 5 | 1 | 72 | 383.475 | 5 | ↓ |