In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 20 | Yes |
Popular Name: (1S)-1-(5-tert-butyl-2-methyl-phenyl)-2-piperazin-1-yl-ethanol (1S)-1-(5-tert-butyl-2-methyl-ph…
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) | 2.54 | 4.32 | -44.8 | 3 | 3 | 1 | 40 | 277.432 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.54 | 6.64 | -126.08 | 4 | 3 | 2 | 41 | 278.44 | 4 | ↓ |