COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL003366
Chemical Name: 5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-1,3-bis(2-methoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccccc1N1C(=O)/C(=C/NC2CCN(CC2)Cc2ccccc2)/C(=O)N(C1=S)c1ccccc1OC

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Molecular Weight: 556.69
Empirical Formula: C31H32N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.181
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 106
Number of rings: 5

     

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