COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK602960
Chemical Name: 1-[1-hydroxy-3,3-dimethyl-11-(3-methylthiophen-2-yl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]propan-1-one
Smiles: CCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)(C)C)C1c1sccc1C

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Molecular Weight: 394.54
Empirical Formula: C23H26N2O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.376
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 81
Number of rings: 4

     

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