COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK648655
Chemical Name: N-{(2S)-1-[(1,3-benzodioxol-5-ylmethyl)amino]-1-oxopropan-2-yl}-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Smiles: O=C([C@@H](NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C)NCc1ccc2c(c1)OCO2

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Molecular Weight: 448.5
Empirical Formula: C23H20N4O4S

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 4.062
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 122
Number of rings: 5

     

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