COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK176966
Chemical Name: (5E)-5-[(2,5-dimethyl-1-{4-[(4-nitrophenyl)sulfanyl]phenyl}-1H-pyrrol-3-yl)methylidene]-1-(4-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2cc(n(c2C)c2ccc(cc2)Sc2ccc(cc2)[N+](=O)[O-])C)/C1=O

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Molecular Weight: 552.61
Empirical Formula: C30H24N4O5S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 6.694
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 142
Number of rings: 5

     

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