| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 7th, 2011 | 20 | No |
Popular Name: (3S,4R)-6-amino-5-cyano-4-(2-fluorophenyl)-2-sulfanyl-3,4-dihydropyridine-3-carboxamide (3S,4R)-6-amino-5-cyano-4-(2-flu…
| 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) | -0.02 | 2.06 | -47.46 | 5 | 5 | 1 | 107 | 291.331 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.02 | 1.66 | -25.73 | 4 | 5 | 0 | 105 | 290.323 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
