In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2005 | 17 | Yes |
Popular Name: BRD-K75399175-003-01-4 BRD-K75399175-003-01-4
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) | -0.86 | 3.98 | -54.72 | 3 | 7 | 1 | 89 | 238.271 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.86 | 4.45 | -111.34 | 4 | 7 | 2 | 91 | 239.279 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0284752A1 | IBM Patent Data |