COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK688802
Chemical Name: 2-amino-4,4-bis[(2-hydroxyethyl)sulfanyl]-6-(3,4,5-trimethoxyphenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile
Smiles: OCCSC1(SCCO)N=C(C2(C1(C#N)C2c1cc(OC)c(c(c1)OC)OC)C#N)N

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Molecular Weight: 464.57
Empirical Formula: C20H24N4O5S2

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: -0.005
Rotatable bonds: 10
H-donors: 4
H-acceptors: 5
PSA: 204
Number of rings: 3

     

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