In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2007 | 26 | No |
Popular Name: 3-(4-chlorophenyl)-6-hydroxy-5-[(4-hydroxy-3-methoxy-phenyl)methylene]pyrimidine-2,4-dione 3-(4-chlorophenyl)-6-hydroxy-5-[…
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) | 2.11 | 2.04 | -43.32 | 1 | 7 | -1 | 104 | 371.756 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.11 | 2.96 | -97.47 | 0 | 7 | -2 | 107 | 370.748 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.11 | 3.07 | -97.72 | 0 | 7 | -2 | 107 | 370.748 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.65 | 4.7 | -10.92 | 2 | 7 | 0 | 101 | 372.764 | 3 | ↓ |