In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2010 | 17 | Yes |
Popular Name: LS-111430 LS-111430
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) | 2.97 | 9 | -40.76 | 1 | 2 | 1 | 8 | 235.326 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.97 | 6.79 | -3.22 | 0 | 2 | 0 | 6 | 234.318 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4518712 | IBM Patent Data |