COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK608717
Chemical Name: N-(4-bromophenyl)-2-[(2S,11aS)-2-hydroxy-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]acetamide
Smiles: O[C@H]1C[C@@H]2N(C1)C(=O)c1c(N(C2=O)CC(=O)Nc2ccc(cc2)Br)cccc1

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Molecular Weight: 444.28
Empirical Formula: C20H18BrN3O4

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 1.023
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 89
Number of rings: 4

     

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