General Information of the Compound
| Compound ID |
CP0381778
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| Compound Name |
(5S)-5-(naphthalen-1-ylmethyl)-1-(4-phenylbut-3-ynyl)-3-(2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione
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| Structure |
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| Formula |
C30H31N3O2
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| Molecular Weight |
465.597
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| Canonical SMILES |
O=C1[C@H](Cc2cccc3ccccc23)N(CCC#Cc2ccccc2)C(=O)N1CCN1CCCC1
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| InChI |
InChI=1S/C30H31N3O2/c34-29-28(23-26-16-10-15-25-14-4-5-17-27(25)26)32(20-7-6-13-24-11-2-1-3-12-24)30(35)33(29)22-21-31-18-8-9-19-31/h1-5,10-12,14-17,28H,7-9,18-23H2/t28-/m0/s1
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| InChIKey |
HJMMYRQSVYVNHK-NDEPHWFRSA-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