In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2009 | 21 | No |
Popular Name: 4-[(2R)-2-(4-tert-butylphenyl)-2-hydroxy-ethyl]piperazine-1-carbaldehyde 4-[(2R)-2-(4-tert-butylphenyl)-2…
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 | 4.47 | -9.77 | 1 | 4 | 0 | 44 | 290.407 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.14 | 6.76 | -50.7 | 2 | 4 | 1 | 45 | 291.415 | 4 | ↓ |