General Information of the Compound
| Compound ID |
CP0480859
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| Compound Name |
[7-methyl-3-(3-nitroanilino)-2-(pentylamino)furo[2,3-c]pyridin-4-yl]methanol
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| Structure |
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| Formula |
C20H24N4O4
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| Molecular Weight |
384.436
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| Canonical SMILES |
CCCCCNc1oc2c(C)ncc(CO)c2c1Nc1cccc(c1)[N+]([O-])=O
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| InChI |
InChI=1S/C20H24N4O4/c1-3-4-5-9-21-20-18(23-15-7-6-8-16(10-15)24(26)27)17-14(12-25)11-22-13(2)19(17)28-20/h6-8,10-11,21,23,25H,3-5,9,12H2,1-2H3
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| InChIKey |
PEWKBGWLJDXYGN-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