In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 20 | Yes |
Popular Name: N-[3-(dimethylaminomethyl)phenyl]-4-methyl-piperazine-1-carboxamide N-[3-(dimethylaminomethyl)phenyl…
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) | 1.36 | 8.01 | -91.85 | 3 | 5 | 2 | 41 | 278.4 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.36 | 5.65 | -45.23 | 2 | 5 | 1 | 40 | 277.392 | 3 | ↓ |