General Information of the Compound
| Compound ID |
CP0557117
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| Compound Name |
4-[[4-(2-aminoethyl)-2-methylphenyl]methyl]phenol
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| Formula |
C16H19NO
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| Molecular Weight |
241.334
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| Canonical SMILES |
Cc1cc(CCN)ccc1Cc1ccc(O)cc1
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| InChI |
InChI=1S/C16H19NO/c1-12-10-14(8-9-17)2-5-15(12)11-13-3-6-16(18)7-4-13/h2-7,10,18H,8-9,11,17H2,1H3
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| InChIKey |
CYLOPQBZFUMRJN-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