In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2009 | 20 | Yes |
Popular Name: (13aS)-3-methyl-5,6,13,13a-tetrahydroisoquinolino[2,1-g][1,6]naphthyridin-8-one (13aS)-3-methyl-5,6,13,13a-tetra…
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) | 2.11 | 7.79 | -9.14 | 0 | 3 | 0 | 33 | 264.328 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4791108; US4886798; US5229387 | IBM Patent Data |