In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | Yes |
Popular Name: 4-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)-isopropyl-amino]butanoic 4-[(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) | 2.18 | 10.09 | -50.99 | 0 | 5 | -1 | 80 | 286.355 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.18 | 8.12 | -10.52 | 1 | 5 | 0 | 77 | 287.363 | 6 | ↓ |