| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 11th, 2006 | 30 | Yes |
Popular Name: 2-(4-isopropylphenyl)amino-N-(3-pyridylmethyl)quinoline-4-carboxamide 2-(4-isopropylphenyl)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) | 5.44 | 9.59 | -10.87 | 2 | 5 | 0 | 70 | 396.494 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.38 | 11.64 | -47.47 | 3 | 5 | 1 | 68 | 397.502 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.44 | 9.72 | -47.35 | 3 | 5 | 1 | 72 | 397.502 | 6 | ↓ |
