COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK614569
Chemical Name: (2E)-2-cyano-3-{[(2Z)-3-[4-(dimethylamino)phenyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-N-(2-methylpropyl)prop-2-enamide
Smiles: N#C/C(=C\N=C\1/SC2C(N1c1ccc(cc1)N(C)C)CS(=O)(=O)C2)/C(=O)NCC(C)C

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Molecular Weight: 461.61
Empirical Formula: C21H27N5O3S2

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 0.953
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 139
Number of rings: 3

     

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