| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 16th, 2010 | 19 | No |
Popular Name: (3R)-4-(4-hydroxyphenyl)-2-thioxo-3,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carbonitrile (3R)-4-(4-hydroxyphenyl)-2-thiox…
| 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) | 1.99 | 6.1 | -16.82 | 1 | 3 | 0 | 56 | 268.341 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 6.87 | -49.18 | 0 | 3 | -1 | 59 | 267.333 | 1 | ↓ |
