General Information of the Compound
| Compound ID |
CP0964843
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| Compound Name |
(R)-N-(2-(1-(1H-Indazol-5-yl)-3-methyl-2,4-dioxo-1,3,8-triazaspiro[4.5]decan-8-yl)-1-cyclopentyl-2-oxoethyl)-2-fluoro-5-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C30H30F4N6O4
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| Molecular Weight |
614.6
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| Canonical SMILES |
CN1C(=O)N(c2ccc3[nH]ncc3c2)C2(CCN(C(=O)[C@H](NC(=O)c3cc(C(F)(F)F)ccc3F)C3CCCC3)CC2)C1=O
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| InChI |
InChI=1S/C30H30F4N6O4/c1-38-27(43)29(40(28(38)44)20-7-9-23-18(14-20)16-35-37-23)10-12-39(13-11-29)26(42)24(17-4-2-3-5-17)36-25(41)21-15-19(30(32,33)34)6-8-22(21)31/h6-9,14-17,24H,2-5,10-13H2,1H3,(H,35,37)(H,36,41)/t24-/m1/s1
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| InChIKey |
NDFQOGBANFMFIE-XMMPIXPASA-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