In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 24th, 2009 | 24 | No |
Popular Name: 1-[(4-chlorophenyl)methyl]-3-ethyl-8-isopropyl-6-thioxo-7H-purin-2-one 1-[(4-chlorophenyl)methyl]-3-eth…
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) | 3.91 | 10.81 | -33.27 | 0 | 5 | -1 | 53 | 361.878 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.