In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: 4-[(3-cyano-6-methyl-2-pyridyl)-isopropyl-amino]butanoic 4-[(3-cyano-6-methyl-2-pyridyl)-…
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) | 1.36 | 8.97 | -51.22 | 0 | 5 | -1 | 80 | 260.317 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.36 | 6.99 | -10.81 | 1 | 5 | 0 | 77 | 261.325 | 6 | ↓ |