| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 17th, 2006 | 28 | No |
Popular Name: 6-amino-2-isopropyl-8-phenethyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile 6-amino-2-isopropyl-8-phenethyl-…
| 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) | 3.66 | 8.39 | -8.23 | 2 | 5 | 0 | 101 | 371.488 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.75 | 2.74 | -114.56 | 3 | 5 | 2 | 101 | 373.504 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.66 | 10.64 | -52.33 | 3 | 5 | 1 | 102 | 372.496 | 4 | ↓ |
