In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 13th, 2004 | 28 | Yes |
Popular Name: N-(4-bromophenyl)-2-[(3-cyano-4-isobutyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]acetamide N-(4-bromophenyl)-2-[(3-cyano-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) | 5.58 | -0.04 | -13.4 | 1 | 4 | 0 | 65 | 458.425 | 6 | ↓ |
Lo Low (pH 4.5-6) | 5.58 | 0.07 | -47.65 | 2 | 4 | 1 | 67 | 459.433 | 6 | ↓ |