In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 19 | Yes |
Popular Name: [3-[[(2S,6R)-2,6-dimethylcyclohexyl]amino]phenyl]urea [3-[[(2S,6R)-2,6-dimethylcyclohe…
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) | 3.96 | 4.37 | -8.68 | 4 | 4 | 0 | 67 | 261.369 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.96 | 3.98 | -39.9 | 5 | 4 | 1 | 72 | 262.377 | 3 | ↓ |