COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406168
Chemical Name: 2-{[5-(5-chloro-1H-indol-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)acetamide
Smiles: O=C(NCc1ccc2c(c1)OCCCO2)CSc1nnc(n1C)c1cc2c([nH]1)ccc(c2)Cl

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Molecular Weight: 483.98
Empirical Formula: C23H22ClN5O3S

Physical State: Dry powder
Available Amount: 51 mg

Lipinsky:
logP: 4.024
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 119
Number of rings: 5

     

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