General Information of the Compound
| Compound ID |
CP0462401
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| Compound Name |
2-(dimethylamino)-N-[3-[4-[[(1S)-2-hydroxy-1-phenylethyl]amino]-6-phenylfuro[2,3-d]pyrimidin-5-yl]phenyl]acetamide
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| Structure |
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| Formula |
C30H29N5O3
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| Molecular Weight |
507.594
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| Canonical SMILES |
CN(C)CC(=O)Nc1cccc(c1)-c1c(oc2ncnc(N[C@H](CO)c3ccccc3)c12)-c1ccccc1
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| InChI |
InChI=1S/C30H29N5O3/c1-35(2)17-25(37)33-23-15-9-14-22(16-23)26-27-29(34-24(18-36)20-10-5-3-6-11-20)31-19-32-30(27)38-28(26)21-12-7-4-8-13-21/h3-16,19,24,36H,17-18H2,1-2H3,(H,33,37)(H,31,32,34)/t24-/m1/s1
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| InChIKey |
HANZKDSBPBFJQB-XMMPIXPASA-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