COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550917
Chemical Name: (2R,3'Z,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-3'-{[(3-oxo-2,3-dihydro-1H-pyrazolo[4,3-c]quinolin-8-yl)amino]methylidene}-2'H,3H,4'H-spiro[1-benzofuran-2,1'-cyclohexane]-2',3,4'-trione
Smiles: COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=O)/C(=C/Nc2ccc3c(c2)c2[nH][nH]c(=O)c2cn3)/C1=O)Cl

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Molecular Weight: 548.94
Empirical Formula: C27H21ClN4O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.386
Rotatable bonds: 2
H-donors: 3
H-acceptors: 7
PSA: 144
Number of rings: 6

     

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