COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552461
Chemical Name: methyl4-(8-acetyl-9-hydroxy-2,7,8,10-tetrahydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-10-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1C2=C(O)N(CC2=Nc2c3c1c[nH]c3ccc2)C(=O)C

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Molecular Weight: 401.42
Empirical Formula: C23H19N3O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.952
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 94
Number of rings: 5

     

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