| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 24 | Yes |
Popular Name: BRD-K72053330-001-01-6 BRD-K72053330-001-01-6
3-[(2-fluorobenzyl)sulfanyl]-1-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[c]pyridine-4-carbonitrile
| 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) | 4.75 | 4.28 | -7.64 | 0 | 2 | 0 | 36 | 352.356 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.75 | 4.39 | -30.17 | 1 | 2 | 1 | 37 | 353.364 | 4 | ↓ |
