In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 20 | Yes |
Popular Name: 1-[4-[(1R,2R)-2-amino-1-(4-bromophenyl)propyl]piperazin-1-yl]ethanone 1-[4-[(1R,2R)-2-amino-1-(4-bromo…
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) | 1.19 | 3.88 | -56.55 | 3 | 4 | 1 | 51 | 341.273 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.19 | 6.14 | -136.72 | 4 | 4 | 2 | 52 | 342.281 | 3 | ↓ |