| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 22 | Yes |
Popular Name: 2-{[3-cyano-4-(3-pyridinyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]sulfanyl}acetamide 2-{[3-cyano-4-(3-pyridinyl)-6,7-…
| 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) | 1.60 | -2.3 | -14.91 | 2 | 5 | 0 | 92 | 310.382 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.60 | -2.09 | -99.35 | 4 | 5 | 2 | 95 | 312.398 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.60 | -2.2 | -47.43 | 3 | 5 | 1 | 93 | 311.39 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.60 | -2.19 | -46.65 | 3 | 5 | 1 | 93 | 311.39 | 4 | ↓ |
