In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2008 | 19 | Yes |
Popular Name: formycin formycin
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) | -1.31 | -6.92 | -15.02 | 6 | 9 | 0 | 150 | 267.245 | 2 | ↓ |
Lo Low (pH 4.5-6) | -1.31 | -11.19 | -40.6 | 7 | 9 | 1 | 152 | 268.253 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4028184 | IBM Patent Data |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z80193-2-O | L1210 (Lymphocytic Leukemia Cells) (cluster #2 Of 12), Other | Other | 200 | 0.49 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z80193 | Z80193 | L1210 (Lymphocytic Leukemia Cells) | 1000 | 0.44 | Functional ≤ 10μM |