General Information of the Compound
| Compound ID |
CP0276514
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| Compound Name |
3-(1H-indol-2-yl)-6-(1H-1,2,3,4-tetrazol-5-yl)-1H-indazole
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| Structure |
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| Formula |
C16H11N7
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| Molecular Weight |
301.313
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| Canonical SMILES |
c1c([nH]c2ccccc12)-c1n[nH]c2cc(ccc12)-c1nnn[nH]1
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| InChI |
InChI=1S/C16H11N7/c1-2-4-12-9(3-1)7-14(17-12)15-11-6-5-10(8-13(11)18-19-15)16-20-22-23-21-16/h1-8,17H,(H,18,19)(H,20,21,22,23)
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| InChIKey |
DYNFZWUFHJDQNP-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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