COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL151066
Chemical Name: 6-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-2-{[(2E)-4,7-dimethylquinazolin-2(3H)-ylidene]amino}pyrimidin-4(1H)-one
Smiles: O=c1cc(CSc2nc3c(s2)cccc3)[nH]c(n1)/N=c\1/nc2cc(C)ccc2c([nH]1)C

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Molecular Weight: 446.56
Empirical Formula: C22H18N6OS2

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 4.473
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 144
Number of rings: 5

     

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