Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L1A6DJ
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| Ligand Name |
(2~{s},4~{r})-1-[(2~{s})-2-(Cyclopropylcarbonylamino)-3,3-Dimethyl-Butanoyl]-~{n}-[[4-(4-Methyl-1,3-Thiazol-5-Yl)phenyl]methyl]-4-Oxidanyl-Pyrrolidine-2-Carboxamide
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| Synonyms |
CHEMBL4227893; (2~{s},4~{r})-1-[(2~{s})-2-(Cyclopropylcarbonylamino)-3,3-Dimethyl-Butanoyl]-~{n}-[[4-(4-Methyl-1,3-Thiazol-5-Yl)phenyl]methyl]-4-Oxidanyl-Pyrrolidine-2-Carboxamide; BDBM50459949; Z4964840772; 9BW
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| Structure |
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Download2D MOL |
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| Formula |
C26H34N4O4S
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| Canonical SMILES |
CC1=C(SC=N1)C2=CC=C(C=C2)CNC(=O)C3CC(CN3C(=O)C(C(C)(C)C)NC(=O)C4CC4)O
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| InChI |
1S/C26H34N4O4S/c1-15-21(35-14-28-15)17-7-5-16(6-8-17)12-27-24(33)20-11-19(31)13-30(20)25(34)22(26(2,3)4)29-23(32)18-9-10-18/h5-8,14,18-20,22,31H,9-13H2,1-4H3,(H,27,33)(H,29,32)/t19-,20+,22-/m1/s1
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| InChIKey |
TXHVAXXHWXOMKR-RZUBCFFCSA-N
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| PubChem Compound ID | ||||
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