COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK052372
Chemical Name: (2E)-4-{[2-(3,4-dimethoxyphenyl)ethyl][1-(4-propoxyphenyl)pyrrolidin-3-yl]amino}-4-oxobut-2-enoicacid
Smiles: CCCOc1ccc(cc1)N1CCC(C1)N(C(=O)/C=C/C(=O)O)CCc1ccc(c(c1)OC)OC

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Molecular Weight: 482.58
Empirical Formula: C27H34N2O6

Physical State: Dry powder
Available Amount: 198 mg

Lipinsky:
logP: 3.309
Rotatable bonds: 11
H-donors: 1
H-acceptors: 6
PSA: 88
Number of rings: 3

     

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