General Information of the Compound
| Compound ID |
CP0463008
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| Compound Name |
2-bicyclo[2.2.1]heptanyl 5-(4-acetamidobutylcarbamoyl)-4-methyl-1H-pyrrole-3-carboxylate
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| Structure |
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| Formula |
C20H29N3O4
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| Molecular Weight |
375.469
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| Canonical SMILES |
CC(=O)NCCCCNC(=O)c1[nH]cc(C(=O)OC2CC3CCC2C3)c1C
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| InChI |
InChI=1S/C20H29N3O4/c1-12-16(20(26)27-17-10-14-5-6-15(17)9-14)11-23-18(12)19(25)22-8-4-3-7-21-13(2)24/h11,14-15,17,23H,3-10H2,1-2H3,(H,21,24)(H,22,25)
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| InChIKey |
GKVZLYPVWDZDLN-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