| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 21 | Yes |
Popular Name: (3S)-2-[(2S)-2-aminohexanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide (3S)-2-[(2S)-2-aminohexanoyl]-3,…
| 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) | 1.14 | 3.7 | -52.2 | 5 | 5 | 1 | 91 | 290.387 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.14 | 3.4 | -10.46 | 4 | 5 | 0 | 89 | 289.379 | 5 | ↓ |
