COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK035573
Chemical Name: 4-[11-(3-butoxyphenyl)-1-hydroxy-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoicacid
Smiles: CCCCOc1cccc(c1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)CCC(=O)O)cccc2)(C)C

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Molecular Weight: 490.6
Empirical Formula: C29H34N2O5

Physical State: Dry powder
Available Amount: 372 mg

Lipinsky:
logP: 6.022
Rotatable bonds: 10
H-donors: 2
H-acceptors: 5
PSA: 99
Number of rings: 4

     

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