In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 24 | No |
Popular Name: (5E)-5-[(3-dimethylaminopropylamino)methylene]-1-(o-tolyl)hexahydropyrimidine-2,4,6-trione (5E)-5-[(3-dimethylaminopropylam…
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) | 0.72 | 6.88 | -49.81 | 3 | 7 | 1 | 88 | 331.396 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.72 | 4.4 | -12.09 | 2 | 7 | 0 | 87 | 330.388 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.72 | 4.4 | -12.14 | 2 | 7 | 0 | 87 | 330.388 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.