COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK000304
Chemical Name: 1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-[(4-phenyl-5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone
Smiles: O=C(N1c2ccccc2CCc2c1cccc2)CSc1nn(c(=S)s1)c1ccccc1

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Molecular Weight: 461.63
Empirical Formula: C24H19N3OS3

Physical State: Dry powder
Available Amount: 427 mg

Lipinsky:
logP: 5.326
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 118
Number of rings: 5

     

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