General Information of the Compound
| Compound ID |
CP0730652
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| Compound Name |
SID17505561
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| Structure |
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| Formula |
C12H10N4O3S
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| Molecular Weight |
290.304
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| Canonical SMILES |
Cc1ccc(C(=O)N/N=C\c2ccc([N+](=O)[O-])s2)cn1
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| InChI |
InChI=1S/C12H10N4O3S/c1-8-2-3-9(6-13-8)12(17)15-14-7-10-4-5-11(20-10)16(18)19/h2-7H,1H3,(H,15,17)/b14-7-
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| InChIKey |
UBNVVKHJWUESPZ-AUWJEWJLSA-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