In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 20 | Yes |
Popular Name: 1-[2-[(2-chloro-3-pyridyl)amino]-2-oxo-ethyl]cyclohexanecarboxylic 1-[2-[(2-chloro-3-pyridyl)amino]…
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) | 2.35 | 6.95 | -55.16 | 1 | 5 | -1 | 82 | 295.746 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.35 | 4.87 | -12.33 | 2 | 5 | 0 | 79 | 296.754 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.