COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK246148
Chemical Name: N-{1-[5-{[1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]ethyl}-2-fluorobenzamide
Smiles: C=CCn1c(nnc1C(NC(=O)c1ccccc1F)C)SC(C(=O)Nc1ccc2c(c1)OCO2)C

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Molecular Weight: 497.55
Empirical Formula: C24H24FN5O4S

Physical State: Dry powder
Available Amount: 118 mg

Lipinsky:
logP: 3.86
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 132
Number of rings: 4

     

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