COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL109844
Chemical Name: (2E)-3-[4-(dimethylamino)phenyl]-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(cc1)N(C)C)/c1nc2c(s1)CCCC2

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Molecular Weight: 309.44
Empirical Formula: C18H19N3S

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 4.947
Rotatable bonds: 1
H-donors: 0
H-acceptors: 0
PSA: 68
Number of rings: 3

     

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