In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2006 | 28 | Yes |
Popular Name: 4-[2-[(3-cyano-6-phenyl-2-pyridyl)sulfanyl]acetyl]aminobenzoic 4-[2-[(3-cyano-6-phenyl-2-pyridy…
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) | 3.95 | 9.66 | -63.87 | 1 | 6 | -1 | 106 | 388.428 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.95 | 9.83 | -90.23 | 2 | 6 | 0 | 107 | 389.436 | 6 | ↓ |