General Information of the Compound
| Compound ID |
CP0706873
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| Compound Name |
SID24779974
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| Structure |
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| Formula |
C14H8N4O4
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| Molecular Weight |
296.242
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| Canonical SMILES |
N#C/C(=C(/O)c1ccc([N+](=O)[O-])o1)c1nc2ccccc2[nH]1
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| InChI |
InChI=1S/C14H8N4O4/c15-7-8(13(19)11-5-6-12(22-11)18(20)21)14-16-9-3-1-2-4-10(9)17-14/h1-6,19H,(H,16,17)/b13-8-
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| InChIKey |
YWCPFQSTQIPHPN-JYRVWZFOSA-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: PT06033, Microphthalmia-associated transcription factor