COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL000804
Chemical Name: 3- bromo- 4- hydroxy- 8,9,10,11- tetrahydro[1]benzothieno[2',3':4,5]pyrimido[1,2- a]azepin- 13(7H)- one
Smiles: Oc1c(Br)ccc2c1sc1c2c(=O)n2c(n1)CCCCC2

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Molecular Weight: 365.25
Empirical Formula: C15H13BrN2O2S

Physical State: Dry powder
Available Amount: 6191 mg

Lipinsky:
logP: 4.505
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 81
Number of rings: 4

     

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