General Information of the Compound
| Compound ID |
CP0053294
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| Compound Name |
3-(1H-Indazol-3-yl)-N,N-dimethylprop-2-yn-1-amine
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| Structure |
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| Formula |
C12H13N3
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| Molecular Weight |
199.257
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| Canonical SMILES |
CN(C)CC#Cc1n[nH]c2ccccc12
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| InChI |
InChI=1S/C12H13N3/c1-15(2)9-5-8-12-10-6-3-4-7-11(10)13-14-12/h3-4,6-7H,9H2,1-2H3,(H,13,14)
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| InChIKey |
RQLKKFJNBKOUGI-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