General Information of the Compound
| Compound ID |
CP0153818
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| Compound Name |
N-[3-[(6R)-8-amino-6-methyl-5H-tetrazolo[1,5-a]pyrazin-6-yl]-4-fluorophenyl]-5-cyanopyridine-2-carboxamide
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| Structure |
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| Formula |
C18H14FN9O
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| Molecular Weight |
391.37
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| Canonical SMILES |
C[C@]1(Cn2nnnc2C(N)=N1)c1cc(NC(=O)c2ccc(cn2)C#N)ccc1F
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| InChI |
InChI=1S/C18H14FN9O/c1-18(9-28-16(15(21)24-18)25-26-27-28)12-6-11(3-4-13(12)19)23-17(29)14-5-2-10(7-20)8-22-14/h2-6,8H,9H2,1H3,(H2,21,24)(H,23,29)/t18-/m0/s1
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| InChIKey |
NXQAJOXTJCKILO-SFHVURJKSA-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