In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 25 | Yes |
Popular Name: 3-[(5-benzyl-4-hydroxy-6-methyl-pyrimidin-2-yl)amino]benzoic 3-[(5-benzyl-4-hydroxy-6-methyl-…
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) | 3.99 | 11.07 | -51.91 | 2 | 6 | -1 | 98 | 334.355 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.44 | 9.47 | -138.99 | 1 | 6 | -2 | 101 | 333.347 | 5 | ↓ |