COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK294086
Chemical Name: (2E)-2-(1,3-benzothiazol-2-ylsulfanyl)-3-[4-(dimethylamino)phenyl]prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(cc1)N(C)C)/Sc1nc2c(s1)cccc2

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Molecular Weight: 337.47
Empirical Formula: C18H15N3S2

Physical State: Dry powder
Available Amount: 115 mg

Lipinsky:
logP: 6.328
Rotatable bonds: 2
H-donors: 0
H-acceptors: 0
PSA: 93
Number of rings: 3

     

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