In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2005 | 25 | Yes |
Popular Name: 2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-phenethyl-acetamide 2-[(3-cyano-5,6,7,8-tetrahydroqu…
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) | 3.65 | -0.65 | -14.06 | 1 | 4 | 0 | 65 | 351.475 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.65 | -0.54 | -47.02 | 2 | 4 | 1 | 67 | 352.483 | 6 | ↓ |