| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 21 | Yes |
Popular Name: (3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-phenyl-propanamidine (3S)-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) | 2.68 | 6.56 | -36.59 | 4 | 3 | 1 | 55 | 280.395 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.68 | 8.47 | -111.88 | 5 | 3 | 2 | 56 | 281.403 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
