General Information of the Compound
| Compound ID |
CP0472672
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| Compound Name |
8-[(3R)-3-azidopyrrolidin-1-yl]-3-(3,4-dimethoxyphenyl)-2,6-dimethylimidazo[1,2-b]pyridazine
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| Structure |
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| Formula |
C20H23N7O2
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| Molecular Weight |
393.451
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| Canonical SMILES |
COc1ccc(cc1OC)-c1c(C)nc2c(cc(C)nn12)N1CC[C@H](C1)N=[N+]=[N-]
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| InChI |
InChI=1S/C20H23N7O2/c1-12-9-16(26-8-7-15(11-26)23-25-21)20-22-13(2)19(27(20)24-12)14-5-6-17(28-3)18(10-14)29-4/h5-6,9-10,15H,7-8,11H2,1-4H3/t15-/m1/s1
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| InChIKey |
UXSAGWNWQRYKEX-OAHLLOKOSA-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