In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2006 | 11 | No |
Popular Name: BRD-A64228451-001-03-5 BRD-A64228451-001-03-5
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) | -0.18 | -1.59 | -35.24 | 1 | 4 | -1 | 73 | 153.113 | 0 | ↓ |
Ref Reference (pH 7) | 1.37 | -3.58 | -11.94 | 3 | 4 | 0 | 72 | 154.121 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4147798; US5744350; US5849541; WO1995012661A1 | IBM Patent Data |