COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL006756
Chemical Name: 5-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methylidene)-1,3-bis(2-methylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1N(C(=O)/C(=C/NCCC2=CCCCC2)/C(=O)N1c1ccccc1C)c1ccccc1C

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Molecular Weight: 459.61
Empirical Formula: C27H29N3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.167
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 84
Number of rings: 4

     

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