COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK231886
Chemical Name: methyl[(4Z)-1-(1,3-benzothiazol-2-yl)-4-(1-{[2-(morpholin-4-yl)ethyl]amino}ethylidene)-5-oxo-4,5-dihydro-1H-pyrazol-3-yl]acetate
Smiles: COC(=O)CC1=NN(C(=O)/C/1=C(\NCCN1CCOCC1)/C)c1nc2c(s1)cccc2

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Molecular Weight: 443.53
Empirical Formula: C21H25N5O4S

Physical State: Dry powder
Available Amount: 410 mg

Lipinsky:
logP: 2.568
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 124
Number of rings: 4

     

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