In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2010 | 34 | Yes |
Popular Name: N-[3-[3-(diisopropylamino)propoxy]-4-methoxy-phenyl]-4-phenyl-benzamide N-[3-[3-(diisopropylamino)propox…
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) | 5.92 | 14.1 | -44.3 | 2 | 5 | 1 | 52 | 461.626 | 11 | ↓ |
Hi High (pH 8-9.5) | 5.92 | 12.06 | -12.24 | 1 | 5 | 0 | 51 | 460.618 | 11 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | WO1999001127A1 | IBM Patent Data |