| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2009 | 16 | Yes |
Popular Name: (2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propanamidine (2S)-3-(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) | 1.57 | 3.88 | -31.3 | 4 | 3 | 1 | 55 | 218.324 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.57 | 5.68 | -108.84 | 5 | 3 | 2 | 56 | 219.332 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.72 | 6.19 | -29.97 | 5 | 3 | 1 | 56 | 218.324 | 3 | ↓ |
