In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 29 | Yes |
Popular Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[4-(m-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) | 2.71 | 8.01 | -42.3 | 2 | 6 | 1 | 55 | 398.527 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.71 | 5.57 | -13.02 | 1 | 6 | 0 | 54 | 397.519 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.