| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 19 | Yes |
Popular Name: (3S)-1-[(4,5-dimethyl-1,2,4-triazol-3-yl)methyl]-3,4-dihydro-2H-quinolin-3-amine (3S)-1-[(4,5-dimethyl-1,2,4-tria…
| 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) | 0.01 | 6.19 | -66.22 | 3 | 5 | 1 | 62 | 258.349 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.01 | 5.87 | -14.1 | 2 | 5 | 0 | 60 | 257.341 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
