In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | No |
Popular Name: (2R)-2-methyl-3-[methyl(7H-purin-6-yl)amino]propanethioamide (2R)-2-methyl-3-[methyl(7H-purin…
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) | 0.52 | 5.5 | -19.1 | 3 | 6 | 0 | 84 | 250.331 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.52 | 5.99 | -36.44 | 4 | 6 | 1 | 85 | 251.339 | 4 | ↓ |