In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 12th, 2006 | 28 | No |
Popular Name: 2-ethoxy-6-[[2-methyl-5-(1-piperidylsulfonyl)phenyl]iminomethyl]phenol 2-ethoxy-6-[[2-methyl-5-(1-piper…
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) | 3.99 | 7.14 | -13.86 | 1 | 6 | 0 | 79 | 402.516 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.99 | 6.63 | -47.14 | 0 | 6 | -1 | 82 | 401.508 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.99 | 8.06 | -56.31 | 0 | 6 | -1 | 82 | 401.508 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.99 | 6.14 | -41.25 | 2 | 6 | 1 | 81 | 403.524 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.99 | 7.5 | -11.84 | 2 | 6 | 0 | 81 | 403.524 | 6 | ↓ |