In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | Yes |
Popular Name: [4-(2-aminoethyl)piperazin-1-yl]-(3-hydroxy-4-methyl-phenyl)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) | -0.04 | -0.07 | -53.07 | 4 | 5 | 1 | 71 | 264.349 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.04 | 2.13 | -130.42 | 5 | 5 | 2 | 73 | 265.357 | 3 | ↓ |