| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2005 | 28 | Yes |
Popular Name: 2-[(10-cyano-8-azabicyclo[5.4.0]undeca-8,10,12-trien-9-yl)sulfanyl]-N-(3-quinolyl)acetamide 2-[(10-cyano-8-azabicyclo[5.4.0]…
| 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) | 4.20 | 9.71 | -15.76 | 1 | 5 | 0 | 79 | 388.496 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.20 | 10 | -41.2 | 2 | 5 | 1 | 80 | 389.504 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.20 | 9.95 | -50.97 | 2 | 5 | 1 | 80 | 389.504 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.20 | 10.23 | -94.54 | 3 | 5 | 2 | 81 | 390.512 | 4 | ↓ |
