COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL065288
Chemical Name: 3-phenylpropyl5-[({2-[(3,4-dimethylphenyl)carbamoyl]phenyl}carbamothioyl)amino]-5-oxopentanoate
Smiles: O=C(NC(=S)Nc1ccccc1C(=O)Nc1ccc(c(c1)C)C)CCCC(=O)OCCCc1ccccc1

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Molecular Weight: 531.68
Empirical Formula: C30H33N3O4S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 6.685
Rotatable bonds: 9
H-donors: 3
H-acceptors: 4
PSA: 128
Number of rings: 3

     

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