COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL535935
Chemical Name: methylN-{3-[(3S)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]propanoyl}-beta-alaninate
Smiles: COC(=O)CCNC(=O)CC[C@@H]1NC(=O)c2c(NC1=O)cccc2

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Molecular Weight: 333.34
Empirical Formula: C16H19N3O5

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: -1.292
Rotatable bonds: 6
H-donors: 3
H-acceptors: 5
PSA: 113
Number of rings: 2

     

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