COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562125
Chemical Name: 1-[11-(2,5-dimethoxyphenyl)-1-hydroxy-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]hexan-1-one
Smiles: CCCCCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)(C)C)C1c1cc(OC)ccc1OC

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Molecular Weight: 476.62
Empirical Formula: C29H36N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.713
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 71
Number of rings: 4

     

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