COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037134
Chemical Name: 1-{(4E)-6-amino-4-[(5-chloro-2-methoxyphenyl)imino]-4,5-dihydro-1,3,5-triazin-2-yl}-3-(1,3-benzothiazol-2-ylsulfanyl)propan-2-one
Smiles: COc1ccc(cc1/N=c\1/nc(CC(=O)CSc2nc3c(s2)cccc3)nc([nH]1)N)Cl

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Molecular Weight: 472.98
Empirical Formula: C20H17ClN6O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.789
Rotatable bonds: 6
H-donors: 3
H-acceptors: 2
PSA: 167
Number of rings: 4

     

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