COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK343461
Chemical Name: propan-2-yl2-({[5-(4-nitrophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CC(OC(=O)c1c(NC(=O)c2cc3n(n2)C(CC(N3)c2ccc(cc2)[N+](=O)[O-])C(F)(F)F)sc2c1CCCC2)C

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Molecular Weight: 577.58
Empirical Formula: C26H26F3N5O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.666
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 159
Number of rings: 5

     

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