In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 25 | Yes |
Popular Name: 2-[(3-aminophenyl)amino]-5-[(3,4-dimethylphenyl)methyl]-6-methyl-pyrimidin-4-ol 2-[(3-aminophenyl)amino]-5-[(3,4…
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) | 3.98 | 9.61 | -11.71 | 4 | 5 | 0 | 84 | 334.423 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.43 | 8.01 | -53.46 | 3 | 5 | -1 | 87 | 333.415 | 4 | ↓ |