In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2009 | 21 | Yes |
Popular Name: (1S,2S)-2-[[(1S)-1-(2-bromophenyl)ethyl]carbamoyl]cyclohexanecarboxylic (1S,2S)-2-[[(1S)-1-(2-bromopheny…
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) | 3.54 | 9.55 | -60.71 | 1 | 4 | -1 | 69 | 353.236 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.54 | 7.52 | -13.12 | 2 | 4 | 0 | 66 | 354.244 | 4 | ↓ |