General Information of the Compound
| Compound ID |
CP0530372
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| Compound Name |
N-[(8S)-8-[(4-ethylphenyl)sulfonylamino]-5,6,7,8-tetrahydronaphthalen-2-yl]-N-[(6-methylpyridin-2-yl)methyl]-3-phenylpropanamide
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| Structure |
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| Formula |
C34H37N3O3S
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| Molecular Weight |
567.755
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| Canonical SMILES |
CCc1ccc(cc1)S(=O)(=O)N[C@H]1CCCc2ccc(cc12)N(Cc1cccc(C)n1)C(=O)CCc1ccccc1
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| InChI |
InChI=1S/C34H37N3O3S/c1-3-26-15-20-31(21-16-26)41(39,40)36-33-14-8-12-28-18-19-30(23-32(28)33)37(24-29-13-7-9-25(2)35-29)34(38)22-17-27-10-5-4-6-11-27/h4-7,9-11,13,15-16,18-21,23,33,36H,3,8,12,14,17,22,24H2,1-2H3/t33-/m0/s1
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| InChIKey |
OZIVHWHJMJVZCH-XIFFEERXSA-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