COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550894
Chemical Name: (2S,8'R)-7-chloro-4,6-dimethoxy-8'-methyl-5'-(thiophen-3-yl)-5',8',9',10'-tetrahydro-3H,6'H-spiro[1-benzofuran-2,7'-[1,2,4]triazolo[3,4-b]quinazoline]-3,6'-dione
Smiles: COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC2=C(C1=O)C(c1ccsc1)n1c(N2)nnc1)Cl

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Molecular Weight: 498.95
Empirical Formula: C23H19ClN4O5S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 5.015
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 132
Number of rings: 6

     

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