COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK380254
Chemical Name: (2Z,5Z)-3-butyl-5-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-2-[(7-nitro-9H-fluoren-2-yl)imino]-1,3-thiazolidin-4-one
Smiles: CCCCN1/C(=N/c2ccc3c(c2)Cc2c3ccc(c2)[N+](=O)[O-])/S/C(=c/2\sc3c(n2CC)cccc3)/C1=O

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Molecular Weight: 542.68
Empirical Formula: C29H26N4O3S2

Physical State: Dry powder
Available Amount: 967 mg

Lipinsky:
logP: 6.226
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 132
Number of rings: 6

     

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