General Information of the Compound
| Compound ID |
CP0681670
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| Compound Name |
(E,E)-N-(Chroman-7-methyl)-N-methyl-5-(4-biphenyl)pent-2,4-dien-1-amine Hydrochloride
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| Structure |
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| Formula |
C28H30ClNO
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| Molecular Weight |
432.007
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| Canonical SMILES |
CN(C/C=C/C=C/c1ccc(-c2ccccc2)cc1)Cc1ccc2c(c1)OCCC2.Cl
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| InChI |
InChI=1S/C28H29NO.ClH/c1-29(22-24-15-18-27-12-8-20-30-28(27)21-24)19-7-3-4-9-23-13-16-26(17-14-23)25-10-5-2-6-11-25;/h2-7,9-11,13-18,21H,8,12,19-20,22H2,1H3;1H/b7-3+,9-4+;
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| InChIKey |
DPEOQNFPYNQYGD-LLHRVUEDSA-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