Inhibitor Report for: N-acyl-prolylpyrrolidine-inhibitor-3
| N-acyl-prolylpyrrolidine-inhibitor-3 | Type (2) |
|---|
| Other_Name | CHEMBL2178963 |
| | BDBM50399734 |
| | 1-[(2s,4s)-4-[4-(4-Fluorophenyl)-1,2,3-Triazol-1-Yl]-2-Pyrrolidin-1-Ylcarbonyl-Pyrrolidin-1-Yl]-4-Phenyl-Butan-1-One |
| | TDV |
| Chemical_Nomenclature | 1-[(2S,4S)-4-[4-(4-fluorophenyl)triazol-1-yl]-2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]-4-phenylbutan-1-one |
| Formula | C27H30FN5O2 |
| MW | 475.56 |
|  |
| Paper | Van Der Veken_2012_J.Med.Chem_55_9856 |
| Structure | 4BCD |
| Gene_locus | pig-ppce |
| CID | 70789754 |
| Family | S9N_PPCE_Peptidase_S9 |
| InChIKey | LGXNBGWSOROIQH-ZCYQVOJMSA-N |
| CanonicalSMILES | C1CCN(C1)C(=O)C2CC(CN2C(=O)CCCC3=CC=CC=C3)N4C=C(N=N4)C5=CC=C(C=C5)F |
| InChI | InChI=1S/C27H30FN5O2/c28-22-13-11-21(12-14-22)24-19-33(30-29-24)23-17-25(27(35)31-15-4-5-16-31)32(18-23)26(34)10-6-9-20-7-2-1-3-8-20/h1-3,7-8,11-14,19,23,25H,4-6,9-10,15-18H2/t23-,25-/m0/s1 |
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