General Information of the Compound
| Compound ID |
CP0480129
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| Compound Name |
(E)-3-[4-[3-(1-adamantyl)phenyl]phenyl]-N-hydroxyprop-2-enamide
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| Structure |
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| Formula |
C25H27NO2
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| Molecular Weight |
373.496
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| Canonical SMILES |
ONC(=O)\C=C\c1ccc(cc1)-c1cccc(c1)C12CC3CC(CC(C3)C1)C2
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| InChI |
InChI=1S/C25H27NO2/c27-24(26-28)9-6-17-4-7-21(8-5-17)22-2-1-3-23(13-22)25-14-18-10-19(15-25)12-20(11-18)16-25/h1-9,13,18-20,28H,10-12,14-16H2,(H,26,27)/b9-6+
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| InChIKey |
IJLVJTFZLLZXDN-RMKNXTFCSA-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