In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 20 | Yes |
Popular Name: 2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]ethanamine 2-[4-[(4-tert-butylphenyl)methyl…
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 | 5.94 | -95.78 | 4 | 3 | 2 | 35 | 277.456 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.14 | 3.55 | -44.17 | 3 | 3 | 1 | 34 | 276.448 | 5 | ↓ |