COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406717
Chemical Name: N-[(8-methoxy-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-2-{[4-methyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: COc1cc2OCCCOc2cc1CNC(=O)CSc1nnc(n1C)c1cccs1

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Molecular Weight: 446.55
Empirical Formula: C20H22N4O4S2

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 3.133
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 141
Number of rings: 4

     

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