| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2005 | 25 | No |
Popular Name: 6-amino-8-benzyl-2-methyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile 6-amino-8-benzyl-2-methyl-1,3,8,…
| 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) | 2.47 | 6.51 | -8.29 | 2 | 5 | 0 | 101 | 329.407 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.47 | 5.1 | -37.23 | 3 | 5 | 1 | 102 | 330.415 | 2 | ↓ |
