| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 25th, 2008 | 24 | No |
Popular Name: 4-[(7S)-5-(4-chlorophenyl)-1,7-dihydro-[1,2,4]triazolo[5,1-b]pyrimidin-7-yl]benzonitrile 4-[(7S)-5-(4-chlorophenyl)-1,7-d…
| 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) | 3.53 | 13.8 | -13.23 | 1 | 5 | 0 | 70 | 333.782 | 2 | ↓ |
| Ref Reference (pH 7) | 3.53 | 12.61 | -16.28 | 0 | 5 | 0 | 67 | 333.782 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.53 | 12.94 | -46.41 | 1 | 5 | 1 | 68 | 334.79 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.53 | 13.13 | -41.05 | 1 | 5 | 1 | 68 | 334.79 | 2 | ↓ |
