COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK302279
Chemical Name: (1-ethyl-4-nitro-1H-pyrazol-3-yl){(7E)-3-(4-methyl-1,3-thiazol-5-yl)-7-[(4-methyl-1,3-thiazol-5-yl)methylidene]-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl}methanone
Smiles: CCn1nc(c(c1)[N+](=O)[O-])C(=O)N1N=C2C(C1c1scnc1C)CCC/C/2=C\c1scnc1C

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Molecular Weight: 497.6
Empirical Formula: C22H23N7O3S2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 1.141
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 178
Number of rings: 5

     

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