In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2004 | 28 | No |
Popular Name: (5E)-1-(3-chloro-4-methyl-phenyl)-4,6-diketo-5-veratrylidene-pyrimidin-2-olate (5E)-1-(3-chloro-4-methyl-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) | 3.00 | 4.9 | -46.05 | 0 | 7 | -1 | 93 | 399.81 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.55 | 7.34 | -11.96 | 1 | 7 | 0 | 90 | 400.818 | 4 | ↓ |