COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK263081
Chemical Name: 3,3-dimethyl-10-[(pyrimidin-2-ylsulfanyl)acetyl]-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CC(C)(C)CC2=C1C(c1cccs1)N(C(=O)CSc1ncccn1)c1c(N2)cccc1

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Molecular Weight: 476.62
Empirical Formula: C25H24N4O2S2

Physical State: Dry powder
Available Amount: 116 mg

Lipinsky:
logP: 4.547
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 128
Number of rings: 5

     

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