General Information of the Compound
| Compound ID |
CP0576320
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| Compound Name |
(4R)-8-[3-(2,3-dichlorophenyl)-2H-pyrazolo[3,4-b]pyrazin-6-yl]-8-azaspiro[4.5]decan-4-amine
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| Structure |
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| Formula |
C20H22Cl2N6
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| Molecular Weight |
417.344
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| Canonical SMILES |
N[C@@H]1CCCC11CCN(CC1)c1cnc2c(n[nH]c2n1)-c1cccc(Cl)c1Cl
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| InChI |
InChI=1S/C20H22Cl2N6/c21-13-4-1-3-12(16(13)22)17-18-19(27-26-17)25-15(11-24-18)28-9-7-20(8-10-28)6-2-5-14(20)23/h1,3-4,11,14H,2,5-10,23H2,(H,25,26,27)/t14-/m1/s1
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| InChIKey |
AKZKUGUQZMUCJC-CQSZACIVSA-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