Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
L32VKP
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Ligand Name |
(10S)-3,3-dimethyl-8-{[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl}-2,3,4,10-tetrahydropyrimido[1,2-a]indol-10-ol
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Synonyms |
(10S)-3,3-dimethyl-8-{[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl}-2,3,4,10-tetrahydropyrimido[1,2-a]indol-10-ol; 3h0e; Q27460970
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Structure |
Download2D MOL |
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Formula |
C24H29N3O4S
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Canonical SMILES |
CC1(CN=C2C(C3=C(N2C1)C=CC(=C3)S(=O)(=O)N4CCCC4COC5=CC=CC=C5)O)C
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InChI |
1S/C24H29N3O4S/c1-24(2)15-25-23-22(28)20-13-19(10-11-21(20)26(23)16-24)32(29,30)27-12-6-7-17(27)14-31-18-8-4-3-5-9-18/h3-5,8-11,13,17,22,28H,6-7,12,14-16H2,1-2H3/t17-,22-/m0/s1
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InChIKey |
RPXBZVLBDLIKLZ-JTSKRJEESA-N
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PubChem Compound ID |
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