Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LHR67X
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| Ligand Name |
N~2~-(Methyl{[2-(Propan-2-Yl)-1,3-Thiazol-4-Yl]methyl}carbamoyl)-N-[(2r,5s)-1-Phenyl-5-{[(1,3-Thiazol-5-Ylmethoxy)carbonyl]amino}octan-2-Yl]-L-Valinamide
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| Synonyms |
N~2~-(Methyl{[2-(Propan-2-Yl)-1,3-Thiazol-4-Yl]methyl}carbamoyl)-N-[(2r,5s)-1-Phenyl-5-{[(1,3-Thiazol-5-Ylmethoxy)carbonyl]amino}octan-2-Yl]-L-Valinamide; GS7; SCHEMBL2760165; CHEMBL3114717; BDBM119128; Q27456698; 7AW; thiazol-5-ylmethyl N-[(1S,4R)-4-[[(2S)-2-[[(2-isopropylthiazol-4-yl)methyl-methyl-carbamoyl]amino]-3-methyl-butanoyl]amino]-5-phenyl-1-propyl-pentyl]carbamate
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| Structure |
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Download2D MOL
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| Formula |
C33H48N6O4S2
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| Canonical SMILES |
CCCC(CCC(CC1=CC=CC=C1)NC(=O)C(C(C)C)NC(=O)N(C)CC2=CSC(=N2)C(C)C)NC(=O)OCC3=CN=CS3
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| InChI |
1S/C33H48N6O4S2/c1-7-11-25(37-33(42)43-19-28-17-34-21-45-28)14-15-26(16-24-12-9-8-10-13-24)35-30(40)29(22(2)3)38-32(41)39(6)18-27-20-44-31(36-27)23(4)5/h8-10,12-13,17,20-23,25-26,29H,7,11,14-16,18-19H2,1-6H3,(H,35,40)(H,37,42)(H,38,41)/t25-,26+,29-/m0/s1
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| InChIKey |
SMWGYCRIYRMWHW-HFASVGIHSA-N
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| PubChem Compound ID | ||||
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