General Information of the Compound
| Compound ID |
CP0389099
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| Compound Name |
8-hydroxy-5-[2-hydroxy-1-[4-(4-phenylbutoxy)butylamino]ethyl]-1H-quinolin-2-one
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| Structure |
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| Formula |
C25H32N2O4
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| Molecular Weight |
424.541
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| Canonical SMILES |
OCC(NCCCCOCCCCc1ccccc1)c1ccc(O)c2[nH]c(=O)ccc12
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| InChI |
InChI=1S/C25H32N2O4/c28-18-22(20-11-13-23(29)25-21(20)12-14-24(30)27-25)26-15-5-7-17-31-16-6-4-10-19-8-2-1-3-9-19/h1-3,8-9,11-14,22,26,28-29H,4-7,10,15-18H2,(H,27,30)
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| InChIKey |
HNFMFCCGXBVVCF-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