COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK604598
Chemical Name: 1-[1-hydroxy-3,3-dimethyl-11-(thiophen-2-yl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-2-(4-methylpiperazin-1-yl)ethanone
Smiles: CN1CCN(CC1)CC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)(C)C)C1c1cccs1

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Molecular Weight: 464.63
Empirical Formula: C26H32N4O2S

Physical State: Dry powder
Available Amount: 322 mg

Lipinsky:
logP: 4.131
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 87
Number of rings: 5

     

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