COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK092028
Chemical Name: 3-(1,3-benzodioxol-5-yl)-3-({4-[4-(tert-butoxycarbonyl)piperazin-1-yl]-4-oxobutanoyl}amino)propanoicacid
Smiles: O=C(NC(c1ccc2c(c1)OCO2)CC(=O)O)CCC(=O)N1CCN(CC1)C(=O)OC(C)(C)C

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Molecular Weight: 477.51
Empirical Formula: C23H31N3O8

Physical State: Dry powder
Available Amount: 134 mg

Lipinsky:
logP: 1.922
Rotatable bonds: 9
H-donors: 2
H-acceptors: 8
PSA: 134
Number of rings: 3

     

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