In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2006 | 36 | Yes |
Popular Name: methyl 2-[({[4-(4-chlorophenyl)-3-cyano-6-phenyl-2-pyridinyl]sulfanyl}acetyl)amino]benzoate methyl 2-[({[4-(4-chlorophenyl)-…
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) | 6.74 | 2.5 | -14.08 | 1 | 6 | 0 | 92 | 514.006 | 8 | ↓ |
Lo Low (pH 4.5-6) | 6.74 | 2.68 | -42.9 | 2 | 6 | 1 | 93 | 515.014 | 8 | ↓ |