In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2010 | 17 | Yes |
Popular Name: LS-111260 LS-111260
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) | 3.48 | 9.45 | -39.64 | 1 | 2 | 1 | 8 | 251.781 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.48 | 7.24 | -2.5 | 0 | 2 | 0 | 6 | 250.773 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4518712 | IBM Patent Data |