| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 25th, 2006 | 25 | No |
Popular Name: 6-amino-8-(4-hydroxyphenyl)-2-methyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile 6-amino-8-(4-hydroxyphenyl)-2-me…
| 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) | 1.88 | 2.67 | -8.45 | 3 | 6 | 0 | 121 | 331.379 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.97 | 0.3 | -114.89 | 4 | 6 | 2 | 121 | 333.395 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.88 | 2.48 | -47.79 | 4 | 6 | 1 | 122 | 332.387 | 1 | ↓ |
