COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL064678
Chemical Name: 3-phenylpropyl{1-[(2,2-dimethylpropanoyl)carbamothioyl]-3-oxopiperazin-2-yl}acetate
Smiles: O=C(CC1C(=O)NCCN1C(=S)NC(=O)C(C)(C)C)OCCCc1ccccc1

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Molecular Weight: 419.55
Empirical Formula: C21H29N3O4S

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 1.174
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 119
Number of rings: 2

     

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