| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 21 | Yes |
Popular Name: (3R)-3-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-3-phenyl-propanamidine (3R)-3-[(4aR,8aS)-3,4,4a,5,6,7,8…
| 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) | 3.46 | 7.86 | -108.38 | 5 | 3 | 2 | 56 | 287.451 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.46 | 6.04 | -35.8 | 4 | 3 | 1 | 55 | 286.443 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
