| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 12th, 2006 | 16 | Yes |
Popular Name: 9-isobutyl-7,8-dimethyl-2,4,9-triazabicyclo[4.3.0]nona-1,3,5,7-tetraen-5-amine 9-isobutyl-7,8-dimethyl-2,4,9-tr…
| 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) | 1.95 | 7.14 | -8.32 | 2 | 4 | 0 | 57 | 218.304 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.95 | 7.46 | -26.78 | 3 | 4 | 1 | 58 | 219.312 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.95 | 3.72 | -25.85 | 3 | 4 | 1 | 58 | 219.312 | 2 | ↓ |
