In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2010 | 25 | Yes |
Popular Name: 2-[3-[[3-(cyclohexylamino)-3-oxo-propyl]carbamoyl]anilino]acetic 2-[3-[[3-(cyclohexylamino)-3-oxo…
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) | 0.58 | 5.05 | -58.75 | 3 | 7 | -1 | 110 | 346.407 | 8 | ↓ |
Lo Low (pH 4.5-6) | 0.58 | 3.07 | -23.53 | 4 | 7 | 0 | 108 | 347.415 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.