COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK638847
Chemical Name: 3-({3-[(2,2-dimethyl-3,4-dihydro-2H-chromen-6-yl)methyl]-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl}methyl)benzoicacid
Smiles: OC(=O)c1cccc(c1)Cn1c(n[nH]c1=S)Cc1ccc2c(c1)CCC(O2)(C)C

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Molecular Weight: 409.51
Empirical Formula: C22H23N3O3S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 4.125
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 106
Number of rings: 4

     

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