In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 12 | No |
Popular Name: 4-hexylthiomorpholine 4-hexylthiomorpholine
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) | 3.18 | 8.2 | -35.99 | 1 | 1 | 1 | 4 | 188.36 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.18 | 6.09 | -1.73 | 0 | 1 | 0 | 3 | 187.352 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0450066A1; EP0450066B1; US5227381; US5401740 | IBM Patent Data |