In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 19th, 2010 | 19 | Yes |
Popular Name: (R)-1-(2-carboxyphenyl methyl)-2-isopropyl piperazine (R)-1-(2-carboxyphenyl methyl)-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) | 1.67 | 6.71 | -77.72 | 2 | 4 | 0 | 60 | 262.353 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.67 | 5.37 | -52.3 | 1 | 4 | -1 | 55 | 261.345 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.67 | 7.93 | -118.97 | 3 | 4 | 1 | 61 | 263.361 | 4 | ↓ |