In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 35 | Yes |
Popular Name: N-(2-cyanoethyl)-[(2,5-dimethylphenyl)methyl]-N-methyl-trioxo-BLAHcarboxamide N-(2-cyanoethyl)-[(2,5-dimethylp…
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 | 11.24 | -25.24 | 0 | 7 | 0 | 99 | 487.581 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.