| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2007 | 22 | Yes |
Popular Name: 7-[(7,8-dimethyl-9-thia-2,4-diazabicyclo[4.3.0]nona-1,3,5,7-tetraen-5-yl)oxy]isoquinoline 7-[(7,8-dimethyl-9-thia-2,4-diaz…
| 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) | 3.86 | -1.17 | -9.06 | 0 | 4 | 0 | 47 | 307.378 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.86 | -1.07 | -39.35 | 1 | 4 | 1 | 49 | 308.386 | 2 | ↓ |
