In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 31 | Yes |
Popular Name: N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-2-[4-(o-tolylmethyl)piperazin-1-yl]acetamide N-[(3,4-dimethoxyphenyl)methyl]-…
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) | 2.81 | 10.98 | -41.25 | 1 | 6 | 1 | 46 | 426.581 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.81 | 9.17 | -12.42 | 0 | 6 | 0 | 45 | 425.573 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.