General Information of the Compound
| Compound ID |
CP0392089
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| Compound Name |
N-[(1S,2S)-1'-[(9-ethylcarbazol-3-yl)methyl]-2-hydroxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
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| Structure |
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| Formula |
C30H33N3O2
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| Molecular Weight |
467.613
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| Canonical SMILES |
CCn1c2ccccc2c2cc(CN3CCC4(CC3)[C@H](O)[C@@H](NC(C)=O)c3ccccc43)ccc12
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| InChI |
InChI=1S/C30H33N3O2/c1-3-33-26-11-7-5-8-22(26)24-18-21(12-13-27(24)33)19-32-16-14-30(15-17-32)25-10-6-4-9-23(25)28(29(30)35)31-20(2)34/h4-13,18,28-29,35H,3,14-17,19H2,1-2H3,(H,31,34)/t28-,29+/m0/s1
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| InChIKey |
WLKCGASCIGZQCK-URLMMPGGSA-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