In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 1st, 2009 | 25 | No |
Popular Name: (5Z)-1-(4-bromophenyl)-5-[(2,4-dihydroxyphenyl)methylene]hexahydropyrimidine-2,4,6-trione (5Z)-1-(4-bromophenyl)-5-[(2,4-d…
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) | 2.34 | -0.66 | -44.42 | 2 | 7 | -1 | 115 | 402.18 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.34 | 0.13 | -102.37 | 1 | 7 | -2 | 118 | 401.172 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.88 | 2 | -9.87 | 3 | 7 | 0 | 112 | 403.188 | 2 | ↓ |