General Information of the Compound
| Compound ID |
CP0527701
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| Compound Name |
7-(4-fluorobenzyl)-5,9-dihydroxy-7H-pyrrolo[3,4-g]quinoline-6,8-dione
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| Formula |
C18H11FN2O4
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| Molecular Weight |
338.294
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| Canonical SMILES |
Oc1c2C(=O)N(Cc3ccc(F)cc3)C(=O)c2c(O)c2ncccc12
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| InChI |
InChI=1S/C18H11FN2O4/c19-10-5-3-9(4-6-10)8-21-17(24)12-13(18(21)25)16(23)14-11(15(12)22)2-1-7-20-14/h1-7,22-23H,8H2
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| InChIKey |
KIDFUEXTTMYIDW-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound