In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 22nd, 2009 | 32 | Yes |
Popular Name: (2R)-4-benzyl-N'-(2-dimethylaminoethyl)-N-(3-methoxyphenyl)piperazine-1,2-dicarboxamide (2R)-4-benzyl-N'-(2-dimethylamin…
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) | 2.14 | 8.2 | -49.16 | 3 | 8 | 1 | 78 | 440.568 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.14 | 5.66 | -19.15 | 2 | 8 | 0 | 77 | 439.56 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.14 | 10.47 | -108.99 | 4 | 8 | 2 | 80 | 441.576 | 8 | ↓ |