In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 20 | Yes |
Popular Name: 4-[[(1R)-1-(2,4-dibromophenyl)ethyl]amino]cyclohexanecarboxamide 4-[[(1R)-1-(2,4-dibromophenyl)et…
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) | 3.64 | 6.06 | -51.2 | 4 | 3 | 1 | 60 | 405.154 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.64 | 5.24 | -9.05 | 3 | 3 | 0 | 55 | 404.146 | 4 | ↓ |