| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 22nd, 2010 | 18 | Yes |
Popular Name: (2S)-2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-methyl-butanenitrile (2S)-2-(3,4-dihydro-1H-isoquinol…
| 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) | 3.09 | 7.79 | -6.67 | 0 | 3 | 0 | 44 | 242.322 | 2 | ↓ |
