In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 21 | Yes |
Popular Name: 7-(2-chlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione 7-(2-chlorobenzyl)-1,3-dimethyl-…
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) | 2.29 | 1.01 | -7.85 | 0 | 6 | 0 | 61 | 304.737 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.29 | 1.26 | -38 | 1 | 6 | 1 | 63 | 305.745 | 2 | ↓ |