General Information of the Compound
| Compound ID |
CP0012184
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| Compound Name |
(3S)-3-(cyclopropylmethyl)-3-methyl-5-[5-(2-methylpyrimidin-5-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-1H-indol-2-one
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| Formula |
C24H22N6O
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| Molecular Weight |
410.481
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| Canonical SMILES |
Cc1ncc(cn1)-c1ccn2ncc(-c3ccc4NC(=O)[C@@](C)(CC5CC5)c4c3)c2n1
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| InChI |
InChI=1S/C24H22N6O/c1-14-25-11-17(12-26-14)20-7-8-30-22(28-20)18(13-27-30)16-5-6-21-19(9-16)24(2,23(31)29-21)10-15-3-4-15/h5-9,11-13,15H,3-4,10H2,1-2H3,(H,29,31)/t24-/m0/s1
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| InChIKey |
BWZJQTMIXIJENC-DEOSSOPVSA-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