COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL069221
Chemical Name: tetrahydrofuran-2-ylmethyl(3-oxo-1-{[(2E)-3-(thiophen-2-yl)prop-2-enoyl]carbamothioyl}piperazin-2-yl)acetate
Smiles: O=C(CC1C(=O)NCCN1C(=S)NC(=O)/C=C/c1cccs1)OCC1CCCO1

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Molecular Weight: 437.54
Empirical Formula: C19H23N3O5S2

Physical State: Dry powder
Available Amount: 86 mg

Lipinsky:
logP: -0.223
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 157
Number of rings: 3

     

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