In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2010 | 25 | Yes |
Popular Name: N2-[4-(1,3-benzothiazol-2-yl)phenyl]-N4,N4-dimethyl-pyrimidine-2,4-diamine N2-[4-(1,3-benzothiazol-2-yl)phe…
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) | 4.90 | 12.43 | -38.26 | 2 | 5 | 1 | 55 | 348.455 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.90 | 11.84 | -12.05 | 1 | 5 | 0 | 54 | 347.447 | 4 | ↓ |