| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 23rd, 2009 | 27 | Yes |
Popular Name: 3-cyclohexyl-9-methyl-5-[(3S)-3-methylpiperazin-1-yl]-[1,2,4]triazolo[4,3-c]quinazoline 3-cyclohexyl-9-methyl-5-[(3S)-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) | 3.99 | 13.5 | -57.21 | 2 | 6 | 1 | 63 | 365.505 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.99 | 12.22 | -10.11 | 1 | 6 | 0 | 58 | 364.497 | 2 | ↓ |
