COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK862868
Chemical Name: methyl4-({6-[(4,5-dicyano-2-nitrophenyl)amino]-1,3-benzothiazol-2-yl}carbamoyl)benzoate
Smiles: COC(=O)c1ccc(cc1)C(=O)Nc1nc2c(s1)cc(cc2)Nc1cc(C#N)c(cc1[N+](=O)[O-])C#N

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Molecular Weight: 498.48
Empirical Formula: C24H14N6O5S

Physical State: Dry powder
Available Amount: 232 mg

Lipinsky:
logP: 4.789
Rotatable bonds: 1
H-donors: 2
H-acceptors: 5
PSA: 201
Number of rings: 4

     

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