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Amb11127747

Duplicate ID
Molecule Name methyl 1-[(3R,5S)-5-({[2-(3-chlorophenyl)ethyl]amino}carbonyl)-1-(3-phenylpropyl)-3-pyrrolidinyl]-1H-1,2,3-triazole-4-carboxylate
SmilesCOC(=O)c1nnn(c1)[C@H]1CN([C@@H](C1)C(=O)NCCc1cccc(c1)Cl)CCCc1ccccc1
InchiKeyKIWVCDFXSSONJB-VWNXMTODSA-N
InChi InChI=1S/C26H30ClN5O3/c1-35-26(34)23-18-32(30-29-23)22-16-24(25(33)28-13-12-20-9-5-11-21(27)15-20)31(17-22)14-6-10-19-7-3-2-4-8-19/h2-5,7-9,11,15,18,22,24H,6,10,12-14,16-17H2,1H3,(H,28,33)/t22-,24+/m1/s1
Formula C26H30ClN5O3
Molecular weight 496.001
Rings 4
logP 3.654
PSA 89.35
MR 137.509
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