In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 25 | Yes |
Popular Name: 3-[[1-[(4-chlorophenyl)methyl]-4,5-dimethyl-imidazol-2-yl]sulfanylmethyl]benzonitrile 3-[[1-[(4-chlorophenyl)methyl]-4…
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) | 4.95 | 13.74 | -11.26 | 0 | 3 | 0 | 42 | 367.905 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.95 | 14.19 | -36.71 | 1 | 3 | 1 | 43 | 368.913 | 5 | ↓ |