| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2009 | 18 | No |
Popular Name: N-[(4-fluorophenyl)methyl]-3-sulfanyl-pyridine-2-carboxamide N-[(4-fluorophenyl)methyl]-3-sul…
| 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) | 2.09 | 5.6 | -50.53 | 1 | 3 | -1 | 42 | 261.301 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.09 | 5.06 | -8.51 | 1 | 3 | 0 | 42 | 262.309 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.09 | 6.06 | -47.22 | 2 | 3 | 0 | 43 | 262.309 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
