| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 21 | No |
Popular Name: 2-[[(1S)-2-(4-fluorophenyl)-1-methyl-ethyl]amino]-6-methyl-pyridine-3-carbothioamide 2-[[(1S)-2-(4-fluorophenyl)-1-me…
| 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) | 3.00 | 8.16 | -12.49 | 3 | 3 | 0 | 51 | 303.406 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 8.46 | -39.65 | 4 | 3 | 1 | 52 | 304.414 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
