COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564657
Chemical Name: 1-[1-hydroxy-11-(1H-indol-3-yl)-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-3-methylbutan-1-one
Smiles: CC(CC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)(C)C)C1c1c[nH]c2c1cccc2)C

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Molecular Weight: 441.57
Empirical Formula: C28H31N3O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.041
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 68
Number of rings: 5

     

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