In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2006 | 18 | No |
Popular Name: 7-nitro-1,3,4,10-tetrahydroacridin-9(2H)-one 7-nitro-1,3,4,10-tetrahydroacrid…
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CAS Numbers: , 873412-28-3
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) | 1.98 | 7.42 | -19.27 | 1 | 5 | 0 | 79 | 244.25 | 1 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425-3-O | Plasmodium Falciparum (cluster #3 Of 22), Other | Other | 379 | 0.50 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50425 | Z50425 | Plasmodium Falciparum | 3160 | 0.43 | Functional ≤ 10μM |