COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL218323
Chemical Name: methyl4-[(N-{[5-chloro-2-(methylsulfanyl)pyrimidin-4-yl]carbonyl}-beta-alanyl)amino]butanoate
Smiles: COC(=O)CCCNC(=O)CCNC(=O)c1nc(SC)ncc1Cl

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Molecular Weight: 374.85
Empirical Formula: C14H19ClN4O4S

Physical State: Dry powder
Available Amount: 15 mg

Lipinsky:
logP: 0.71
Rotatable bonds: 10
H-donors: 2
H-acceptors: 4
PSA: 135
Number of rings: 1

     

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