COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL365475
Chemical Name: methyl4-{[({4-methyl-5-[1-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)ethyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1C)C(N1C(=O)COc2c1cccc2)C

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Molecular Weight: 481.53
Empirical Formula: C23H23N5O5S

Physical State: Dry powder
Available Amount: 1040 mg

Lipinsky:
logP: 4.025
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 140
Number of rings: 4

     

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