General Information of the Compound
| Compound ID |
CP0775776
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| Compound Name |
(R)-6-chloro-3-(1-(4-fluorophenyl)-1H-pyrazol-4-yl)-N-(pyrrolidin-3-yl)-1H-indazol-5-amine
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| Formula |
C20H18ClFN6
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| Molecular Weight |
396.857
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| Canonical SMILES |
Fc1ccc(-n2cc(-c3n[nH]c4cc(Cl)c(N[C@@H]5CCNC5)cc34)cn2)cc1
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| InChI |
InChI=1S/C20H18ClFN6/c21-17-8-18-16(7-19(17)25-14-5-6-23-10-14)20(27-26-18)12-9-24-28(11-12)15-3-1-13(22)2-4-15/h1-4,7-9,11,14,23,25H,5-6,10H2,(H,26,27)/t14-/m1/s1
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| InChIKey |
WNHCPZOJESINGK-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