COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK674653
Chemical Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(6-{[(E)-{4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Smiles: COc1cc(CCNC(=O)CSc2nc3c(s2)cc(cc3)/N=C/c2ccc(c(c2)[N+](=O)[O-])Sc2nnc(s2)C)ccc1OC

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Molecular Weight: 666.83
Empirical Formula: C29H26N6O5S4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.953
Rotatable bonds: 11
H-donors: 1
H-acceptors: 5
PSA: 251
Number of rings: 5

     

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