| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 26 | Yes |
Popular Name: 3-cyclohexyl-5-[(3S)-3-methylpiperazin-1-yl]-[1,2,4]triazolo[4,3-c]quinazoline 3-cyclohexyl-5-[(3S)-3-methylpip…
| 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) | 3.56 | 12.85 | -57.25 | 2 | 6 | 1 | 63 | 351.478 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.56 | 11.58 | -11.3 | 1 | 6 | 0 | 58 | 350.47 | 2 | ↓ |
