COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK761486
Chemical Name: ethyl4-{(2E)-3-(1,3-benzodioxol-5-yl)-2-[(thiophen-2-ylcarbonyl)amino]prop-2-enoyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1cccs1

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Molecular Weight: 457.51
Empirical Formula: C22H23N3O6S

Physical State: Dry powder
Available Amount: 56 mg

Lipinsky:
logP: 1.652
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 125
Number of rings: 4

     

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