General Information of the Compound
| Compound ID |
CP0447841
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| Compound Name |
3-chloro-5-ethyl-2-hydroxy-6-methoxy-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzamide
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| Structure |
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| Formula |
C22H28ClN3O3
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| Molecular Weight |
417.937
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| Canonical SMILES |
CCc1cc(Cl)c(O)c(C(=O)NCCN2CCN(CC2)c2ccccc2)c1OC
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| InChI |
InChI=1S/C22H28ClN3O3/c1-3-16-15-18(23)20(27)19(21(16)29-2)22(28)24-9-10-25-11-13-26(14-12-25)17-7-5-4-6-8-17/h4-8,15,27H,3,9-14H2,1-2H3,(H,24,28)
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| InChIKey |
JYESXVUAVVIFNX-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