In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 19 | Yes |
Popular Name: 5-[[(2S,6R)-2,6-dimethylcyclohexyl]amino]-3H-1,3-benzoxazol-2-one 5-[[(2S,6R)-2,6-dimethylcyclohex…
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) | 4.07 | 5.54 | -7.52 | 2 | 4 | 0 | 58 | 260.337 | 2 | ↓ |
Hi High (pH 8-9.5) | 4.52 | 2.9 | -48.32 | 1 | 4 | -1 | 61 | 259.329 | 2 | ↓ |