In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2009 | 27 | Yes |
Popular Name: [3-tert-butyl-4-hydroxy-5-[(4-methylpiperazin-1-yl)methyl]phenyl]-phenyl-methanone [3-tert-butyl-4-hydroxy-5-[(4-me…
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) | 4.43 | 9.12 | -42.02 | 2 | 4 | 1 | 45 | 367.513 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0331195A2; US4927835 | IBM Patent Data |