| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 20 | Yes |
Popular Name: (3S)-N-(2-cyanoethyl)-N-isopropyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide (3S)-N-(2-cyanoethyl)-N-isopropy…
| 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) | 0.96 | 6.41 | -11.85 | 1 | 4 | 0 | 56 | 271.364 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.96 | 7.67 | -48.14 | 2 | 4 | 1 | 61 | 272.372 | 4 | ↓ |
