General Information of the Compound
| Compound ID |
CP0022216
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| Compound Name |
4-(propan-2-ylamino)-7-pyridin-4-ylcinnoline-3-carboxamide
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| Structure |
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| Formula |
C17H17N5O
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| Molecular Weight |
307.357
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| Canonical SMILES |
CC(C)Nc1c(nnc2cc(ccc12)-c1ccncc1)C(N)=O
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| InChI |
InChI=1S/C17H17N5O/c1-10(2)20-15-13-4-3-12(11-5-7-19-8-6-11)9-14(13)21-22-16(15)17(18)23/h3-10H,1-2H3,(H2,18,23)(H,20,21)
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| InChIKey |
INDQWOOKLCAIBK-UHFFFAOYSA-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