COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406081
Chemical Name: N-cyclopentyl-2-{[5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(NC1CCCC1)CSc1nnc(n1C(C)C)c1ccc2c(c1)OCCCO2

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Molecular Weight: 416.54
Empirical Formula: C21H28N4O3S

Physical State: Dry powder
Available Amount: 44 mg

Lipinsky:
logP: 4.671
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 103
Number of rings: 4

     

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