General Information of the Compound
| Compound ID |
CP0757529
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| Compound Name |
N1-(3-Phenylbutanoyl)-N2-[3-(pyridin-2-yl)propyl]guanidine
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| Structure |
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| Formula |
C19H24N4O
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| Molecular Weight |
324.428
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| Canonical SMILES |
CC(CC(=O)/N=C(\N)NCCCc1ccccn1)c1ccccc1
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| InChI |
InChI=1S/C19H24N4O/c1-15(16-8-3-2-4-9-16)14-18(24)23-19(20)22-13-7-11-17-10-5-6-12-21-17/h2-6,8-10,12,15H,7,11,13-14H2,1H3,(H3,20,22,23,24)
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| InChIKey |
MJOSRXMZZADWFY-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