General Information of the Compound
| Compound ID |
CP0540168
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| Compound Name |
N-[2-(7-hydroxynaphthalen-1-yl)ethyl]but-3-enamide
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| Structure |
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| Formula |
C16H17NO2
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| Molecular Weight |
255.317
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| Canonical SMILES |
Oc1ccc2cccc(CCNC(=O)CC=C)c2c1
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| InChI |
InChI=1S/C16H17NO2/c1-2-4-16(19)17-10-9-13-6-3-5-12-7-8-14(18)11-15(12)13/h2-3,5-8,11,18H,1,4,9-10H2,(H,17,19)
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| InChIKey |
KXFDSFNLNANUGU-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