In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2010 | 29 | Yes |
Popular Name: 3-(3,4-dimethoxyphenyl)-N-[3-methyl-4-(4-methylpiperazin-1-yl)phenyl]propanamide 3-(3,4-dimethoxyphenyl)-N-[3-met…
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) | 3.46 | 10.77 | -45.39 | 2 | 6 | 1 | 55 | 398.527 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.46 | 8.39 | -11.96 | 1 | 6 | 0 | 54 | 397.519 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.