In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 25th, 2007 | 23 | No |
Popular Name: N-[(2-chlorophenyl)methyl]-2-[(2-chloro-9H-purin-6-yl)sulfanyl]acetamide N-[(2-chlorophenyl)methyl]-2-[(2…
None
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) | 2.68 | 6.82 | -16.02 | 2 | 6 | 0 | 84 | 368.249 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.68 | 6.34 | -40.27 | 1 | 6 | -1 | 82 | 367.241 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.