Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L4N2GO
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| Ligand Name |
N-{3-[(2r)-1-{(2r)-2-[(1-Aminoisoquinolin-6-Yl)amino]-2-Phenylacetyl}pyrrolidin-2-Yl]-4-(Propan-2-Ylsulfonyl)phenyl}acetamide
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| Synonyms |
CHEMBL3594315; N-{3-[(2r)-1-{(2r)-2-[(1-Aminoisoquinolin-6-Yl)amino]-2-Phenylacetyl}pyrrolidin-2-Yl]-4-(Propan-2-Ylsulfonyl)phenyl}acetamide; SCHEMBL2911618; BDBM50098600; Q27454938; 4T0
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| Structure |
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Download2D MOL |
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| Formula |
C32H35N5O4S
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| Canonical SMILES |
CC(C)S(=O)(=O)C1=C(C=C(C=C1)NC(=O)C)C2CCCN2C(=O)C(C3=CC=CC=C3)NC4=CC5=C(C=C4)C(=NC=C5)N
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| InChI |
1S/C32H35N5O4S/c1-20(2)42(40,41)29-14-12-25(35-21(3)38)19-27(29)28-10-7-17-37(28)32(39)30(22-8-5-4-6-9-22)36-24-11-13-26-23(18-24)15-16-34-31(26)33/h4-6,8-9,11-16,18-20,28,30,36H,7,10,17H2,1-3H3,(H2,33,34)(H,35,38)/t28-,30-/m1/s1
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| InChIKey |
KDJVHAKXSVDSAV-PQHLKRTFSA-N
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| PubChem Compound ID | ||||
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