COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK109874
Chemical Name: 2-({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)-N'-[(1E,2Z)-3-(2-nitrophenyl)prop-2-en-1-ylidene]acetohydrazide
Smiles: O=C(CSc1nnc(s1)SCc1ccc(cc1)C)N/N=C/C=C\c1ccccc1[N+](=O)[O-]

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Molecular Weight: 485.61
Empirical Formula: C21H19N5O3S3

Physical State: Dry powder
Available Amount: 295 mg

Lipinsky:
logP: 6.468
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 191
Number of rings: 3

     

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