COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056400
Chemical Name: 2-{[(4,6-dioxo-1,3-diphenyl-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}-N,N,N-trimethylethanaminium
Smiles: O=C1/C(=C/NCC[N+](C)(C)C)/C(=O)N(C(=S)N1c1ccccc1)c1ccccc1

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Saltdata: I-
Molecular Weight: 409.53
Empirical Formula: C22H25N4O2S

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: -1.075
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 84
Number of rings: 3

     

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