Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LEKI16
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| Ligand Name |
(7~{r})-7-[(3,5-Dimethyl-1,2-Oxazol-4-Yl)methylamino]-3-[(4-Methoxynaphthalen-1-Yl)methyl]-5,6,7,8-Tetrahydro-[1]benzothiolo[2,3-D]pyrimidin-4-One
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| Synonyms |
(7~{r})-7-[(3,5-Dimethyl-1,2-Oxazol-4-Yl)methylamino]-3-[(4-Methoxynaphthalen-1-Yl)methyl]-5,6,7,8-Tetrahydro-[1]benzothiolo[2,3-D]pyrimidin-4-One
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| Structure |
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Download2D MOL |
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| Formula |
C28H28N4O3S
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| Canonical SMILES |
CC1=C(C(=NO1)C)CNC2CCC3=C(C2)SC4=C3C(=O)N(C=N4)CC5=CC=C(C6=CC=CC=C56)OC
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| InChI |
1S/C28H28N4O3S/c1-16-23(17(2)35-31-16)13-29-19-9-10-22-25(12-19)36-27-26(22)28(33)32(15-30-27)14-18-8-11-24(34-3)21-7-5-4-6-20(18)21/h4-8,11,15,19,29H,9-10,12-14H2,1-3H3/t19-/m1/s1
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| InChIKey |
HBGRZTNWJBBJHU-LJQANCHMSA-N
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| PubChem Compound ID | ||||
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