| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2005 | 29 | No |
Popular Name: 3-cyclopentyl-N-methyl-4-oxo-N-[2-(2-pyridyl)ethyl]-2-thioxo-1H-quinazoline-7-carboxamide 3-cyclopentyl-N-methyl-4-oxo-N-[…
| 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) | 2.74 | 10.29 | -44.87 | 0 | 6 | -1 | 68 | 407.519 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.02 | 10.71 | -14.46 | 1 | 6 | 0 | 71 | 408.527 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.02 | 11.09 | -48.19 | 2 | 6 | 1 | 72 | 409.535 | 5 | ↓ |
