COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL440878
Chemical Name: 1-[(5Z)-2-(4-chlorophenyl)-4-(pyrrolidin-1-ylcarbonyl)-1,2,3-thiadiazol-5(2H)-ylidene]-3-methylthiourea
Smiles: CNC(=S)/N=c/1\sn(nc1C(=O)N1CCCC1)c1ccc(cc1)Cl

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Molecular Weight: 381.91
Empirical Formula: C15H16ClN5OS2

Physical State: Dry powder
Available Amount: 78 mg

Lipinsky:
logP: 1.481
Rotatable bonds: 1
H-donors: 1
H-acceptors: 1
PSA: 117
Number of rings: 3

     

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