In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2012 | 25 | Yes |
Popular Name: (6R)-6-pyrazin-2-yloxy-4-[[3-(trifluoromethyl)phenyl]methyl]-1,4-oxazepane (6R)-6-pyrazin-2-yloxy-4-[[3-(tr…
None
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) | 3.10 | 4.4 | -7.24 | 0 | 5 | 0 | 47 | 353.344 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.10 | 6.29 | -46.15 | 1 | 5 | 1 | 49 | 354.352 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.