In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | Yes |
Popular Name: [4-(2-aminoethyl)piperazin-1-yl]-(2,4-dimethylphenyl)methanone [4-(2-aminoethyl)piperazin-1-yl]…
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) | 0.43 | 3.4 | -50.18 | 3 | 4 | 1 | 51 | 262.377 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.43 | 5.6 | -126.9 | 4 | 4 | 2 | 52 | 263.385 | 3 | ↓ |