COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK602287
Chemical Name: 2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[1-hydroxy-3,3-dimethyl-11-(thiophen-2-yl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethanone
Smiles: Nc1nnc([nH]1)SCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)(C)C)C1c1cccs1

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Molecular Weight: 480.61
Empirical Formula: C23H24N6O2S2

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 4.441
Rotatable bonds: 5
H-donors: 4
H-acceptors: 2
PSA: 174
Number of rings: 5

     

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