General Information of the Compound
| Compound ID |
CP0087779
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| Compound Name |
4-[1-(7-fluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)-3,3-dimethyl-2H-indol-6-yl]morpholine
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| Structure |
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| Formula |
C29H29FN4O
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| Molecular Weight |
468.576
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| Canonical SMILES |
Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1ccccn1
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| InChI |
InChI=1S/C29H29FN4O/c1-19-27(24-6-4-5-11-31-24)32-25-16-20(30)7-9-22(25)28(19)34-18-29(2,3)23-10-8-21(17-26(23)34)33-12-14-35-15-13-33/h4-11,16-17H,12-15,18H2,1-3H3
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| InChIKey |
KSCBFWORETXFLG-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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