In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 25th, 2010 | 17 | Yes |
Popular Name: N-methyl-N-[(1S)-1,2,2-trimethylpropyl]-7H-purin-6-amine N-methyl-N-[(1S)-1,2,2-trimethyl…
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) | 2.89 | 8.44 | -13.67 | 1 | 5 | 0 | 58 | 233.319 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.89 | 8.93 | -29.6 | 2 | 5 | 1 | 59 | 234.327 | 3 | ↓ |