In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 23 | Yes |
Popular Name: 2-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide 2-[(3-cyano-6,7-dihydro-5H-cyclo…
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) | 3.19 | 0.74 | -14.08 | 1 | 4 | 0 | 65 | 327.384 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.19 | 0.84 | -48.88 | 2 | 4 | 1 | 67 | 328.392 | 4 | ↓ |