General Information of the Compound
| Compound ID |
CP0372101
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| Compound Name |
(R)-N,N-dimethyl-4-(3-(2-(3-methyl-2,5-dioxo-1',3'-dihydrospiro[imidazolidine-4,2'-indene]-5'-ylamino)-2-oxoethyl)-2-oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)butanamide
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| Structure |
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| Formula |
C27H30N6O5
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| Molecular Weight |
518.574
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| Canonical SMILES |
CN(C)C(=O)CCCn1c2ccccc2n(CC(=O)Nc2ccc3C[C@]4(Cc3c2)N(C)C(=O)NC4=O)c1=O
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| InChI |
InChI=1S/C27H30N6O5/c1-30(2)23(35)9-6-12-32-20-7-4-5-8-21(20)33(26(32)38)16-22(34)28-19-11-10-17-14-27(15-18(17)13-19)24(36)29-25(37)31(27)3/h4-5,7-8,10-11,13H,6,9,12,14-16H2,1-3H3,(H,28,34)(H,29,36,37)/t27-/m1/s1
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| InChIKey |
YYWRTYIKIIRBJZ-HHHXNRCGSA-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