General Information of the Compound
| Compound ID |
CP0467916
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| Compound Name |
1-Butyl-3-{3-methoxy-2-propoxy-5-[5-(3,4,5-trimethoxy-phenyl)-tetrahydro-furan-2-yl]-phenyl}-1-hydroxy-urea
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| Structure |
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| Formula |
C28H40N2O8
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| Molecular Weight |
532.634
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| Canonical SMILES |
CCCCN(O)C(=O)Nc1cc(cc(OC)c1OCCC)[C@@H]1CC[C@H](O1)c1cc(OC)c(OC)c(OC)c1
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| InChI |
InChI=1S/C28H40N2O8/c1-7-9-12-30(32)28(31)29-20-14-18(15-23(33-3)26(20)37-13-8-2)21-10-11-22(38-21)19-16-24(34-4)27(36-6)25(17-19)35-5/h14-17,21-22,32H,7-13H2,1-6H3,(H,29,31)/t21-,22-/m0/s1
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| InChIKey |
TWOSZZZGHRJMJC-VXKWHMMOSA-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