COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL162888
Chemical Name: 2-[3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1(6H)-yl]-N-[(2Z)-3,4,5,6,7,8-hexahydro-2H-cyclohepta[d][1,3]thiazol-2-ylidene]acetamide
Smiles: COc1cc(ccc1OC)c1ccc(=O)n(n1)CC(=O)/N=c/1\sc2c([nH]1)CCCCC2

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Molecular Weight: 440.52
Empirical Formula: C22H24N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.085
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 117
Number of rings: 4

     

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