In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2011 | 25 | No |
Popular Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]ethanone 1-(3,4-dihydro-2H-quinolin-1-yl)…
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) | 3.66 | 11.63 | -17.41 | 0 | 4 | 0 | 38 | 351.475 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.66 | 12.07 | -32.18 | 1 | 4 | 1 | 39 | 352.483 | 4 | ↓ |