General Information of the Compound
| Compound ID |
CP0425867
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| Compound Name |
1'-acetyl-N-[(2-chlorophenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-2-methylspiro[2H-indole-3,4'-piperidine]-5-carboxamide
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| Structure |
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| Formula |
C30H32ClN3O5S
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| Molecular Weight |
582.122
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| Canonical SMILES |
COc1ccc(cc1)S(=O)(=O)N1C(C)C2(CCN(CC2)C(C)=O)c2cc(ccc12)C(=O)NCc1ccccc1Cl
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| InChI |
InChI=1S/C30H32ClN3O5S/c1-20-30(14-16-33(17-15-30)21(2)35)26-18-22(29(36)32-19-23-6-4-5-7-27(23)31)8-13-28(26)34(20)40(37,38)25-11-9-24(39-3)10-12-25/h4-13,18,20H,14-17,19H2,1-3H3,(H,32,36)
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| InChIKey |
NSPKPBVUVFCVKY-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