In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2005 | 24 | Yes |
Popular Name: N-[3-[2-(4,6-diaminopyrimidin-2-yl)sulfanylacetyl]amino-4-methyl-phenyl]acetamide N-[3-[2-(4,6-diaminopyrimidin-2-…
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) | 1.32 | -6.41 | -18.08 | 6 | 8 | 0 | 136 | 346.416 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.32 | -6.18 | -47.18 | 7 | 8 | 1 | 137 | 347.424 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.32 | -6.02 | -117.27 | 8 | 8 | 2 | 138 | 348.432 | 5 | ↓ |