In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 14th, 2008 | 27 | Yes |
Popular Name: 7-(4-fluorobenzyl)-8-[(3-methoxypropyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione 7-(4-fluorobenzyl)-8-[(3-methoxy…
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) | 2.25 | 9.92 | -12.09 | 1 | 8 | 0 | 83 | 375.404 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.25 | 10.35 | -44.57 | 2 | 8 | 1 | 84 | 376.412 | 7 | ↓ |