In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 25 | No |
Popular Name: (Z)-1-(3-chloro-4-methylphenyl)-5-(4-hydroxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione (Z)-1-(3-chloro-4-methylphenyl)-…
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) | 2.88 | 3.53 | -47.95 | 1 | 6 | -1 | 95 | 355.757 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.88 | 4.32 | -96.85 | 0 | 6 | -2 | 98 | 354.749 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.42 | 5.3 | -13.49 | 2 | 6 | 0 | 92 | 356.765 | 2 | ↓ |