In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2005 | 29 | Yes |
Popular Name: 1-[6-[2-(trifluoromethyl)phenyl]quinazolin-4-yl]piperidine-4-carboxylic 1-[6-[2-(trifluoromethyl)phenyl]…
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) | 4.40 | 13.18 | -51.04 | 0 | 5 | -1 | 69 | 400.38 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.40 | 13.63 | -62.28 | 1 | 5 | 0 | 70 | 401.388 | 4 | ↓ |