General Information of the Compound
| Compound ID |
CP0763998
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| Compound Name |
MMV1455158
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| Structure |
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| Formula |
C17H21N5
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| Molecular Weight |
295.39
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| Canonical SMILES |
CCN(Cc1ccccc1)c1ccc(/C=N/N=C(N)N)cc1
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| InChI |
InChI=1S/C17H21N5/c1-2-22(13-15-6-4-3-5-7-15)16-10-8-14(9-11-16)12-20-21-17(18)19/h3-12H,2,13H2,1H3,(H4,18,19,21)/b20-12+
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| InChIKey |
SBDIXHSCQKEGEH-UDWIEESQSA-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
Protein ID: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06033, Microphthalmia-associated transcription factor