COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL064088
Chemical Name: ethyl(1-{[(2E)-3-(naphthalen-1-yl)prop-2-enoyl]carbamothioyl}-3-oxopiperazin-2-yl)acetate
Smiles: CCOC(=O)CC1C(=O)NCCN1C(=S)NC(=O)/C=C/c1cccc2c1cccc2

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Molecular Weight: 425.51
Empirical Formula: C22H23N3O4S

Physical State: Dry powder
Available Amount: 127 mg

Lipinsky:
logP: 1.744
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 119
Number of rings: 3

     

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