| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 17th, 2005 | 25 | No |
Popular Name: 6-amino-8-(4-chlorophenyl)-2-methyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile 6-amino-8-(4-chlorophenyl)-2-met…
| 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) | 3.04 | 6.05 | -7.42 | 2 | 5 | 0 | 101 | 349.825 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.13 | 2.11 | -115.32 | 3 | 5 | 2 | 101 | 351.841 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 3.04 | 5.85 | -47.43 | 3 | 5 | 1 | 102 | 350.833 | 1 | ↓ |
