COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550324
Chemical Name: methyl4-[8-acetyl-9-hydroxy-2-(2-methylpropyl)-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=Nc2c3c1cn(c3ccc2)CC(C)C)C(=O)C

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Molecular Weight: 457.53
Empirical Formula: C27H27N3O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.759
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 84
Number of rings: 5

     

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