Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LBP7R0
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| Ligand Name |
2-N-[4-(cyclopropylmethoxy)-3,5-difluorophenyl]-5-[(3R)-3-methylpiperazin-1-yl]-4-N-(oxan-4-yl)pyrimidine-2,4-diamine
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| Synonyms |
CHEMBL4756823; BDBM50563636; (R)-N2-(4-(cyclopropylmethoxy)-3,5-difluorophenyl)-5-(3-methylpiperazin-1-yl)-N4-(tetrahydro-2H-pyran-4-yl)pyrimidine-2,4-diamine; S4N
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| Structure |
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Download2D MOL |
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| Formula |
C24H32F2N6O2
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| Canonical SMILES |
CC1CN(CCN1)C2=CN=C(N=C2NC3CCOCC3)NC4=CC(=C(C(=C4)F)OCC5CC5)F
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| InChI |
1S/C24H32F2N6O2/c1-15-13-32(7-6-27-15)21-12-28-24(31-23(21)29-17-4-8-33-9-5-17)30-18-10-19(25)22(20(26)11-18)34-14-16-2-3-16/h10-12,15-17,27H,2-9,13-14H2,1H3,(H2,28,29,30,31)/t15-/m1/s1
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| InChIKey |
FPYULJCYPOLXGV-OAHLLOKOSA-N
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| PubChem Compound ID | ||||
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