In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 24 | Yes |
Popular Name: 2-[[(6S)-3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl]thio]-N-phenyl-acetamide 2-[[(6S)-3-cyano-6-methyl-5,6,7,…
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) | 3.77 | 0.39 | -13.14 | 1 | 4 | 0 | 65 | 337.448 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.77 | 0.5 | -47.1 | 2 | 4 | 1 | 67 | 338.456 | 4 | ↓ |