COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL540571
Chemical Name: N-{2-hydroxy-3-[2-(methylsulfanyl)ethyl]-5-oxo-4,5-dihydro-3H-1,4-benzodiazepin-7-yl}-2-(4-hydroxyphthalazin-1-yl)acetamide
Smiles: CSCCC1NC(=O)c2c(N=C1O)ccc(c2)NC(=O)Cc1nnc(c2c1cccc2)O

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Molecular Weight: 451.51
Empirical Formula: C22H21N5O4S

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: -0.925
Rotatable bonds: 7
H-donors: 4
H-acceptors: 4
PSA: 162
Number of rings: 4

     

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