General Information of the Compound
| Compound ID |
CP0869423
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| Compound Name |
(4S)-6-amino-4-[4-(dimethylamino)phenyl]-3-(4-methylphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
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| Structure |
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| Formula |
C22H21N5O
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| Molecular Weight |
371.444
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| Canonical SMILES |
Cc1ccc(-c2n[nH]c3c2[C@@H](c2ccc(N(C)C)cc2)C(C#N)=C(N)O3)cc1
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| InChI |
InChI=1S/C22H21N5O/c1-13-4-6-15(7-5-13)20-19-18(14-8-10-16(11-9-14)27(2)3)17(12-23)21(24)28-22(19)26-25-20/h4-11,18H,24H2,1-3H3,(H,25,26)/t18-/m0/s1
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| InChIKey |
AKVGQFWVWIASKQ-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