COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK891450
Chemical Name: 2-{(2E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl}-4-nitrophenyl2-(acetylamino)-2-deoxyhexopyranoside
Smiles: OCC1OC(Oc2ccc(cc2C(=O)/C=C/c2ccc(cc2)N(C)C)[N+](=O)[O-])C(C(C1O)O)NC(=O)C

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Molecular Weight: 515.52
Empirical Formula: C25H29N3O9

Physical State: Dry powder
Available Amount: 141 mg

Lipinsky:
logP: 2.293
Rotatable bonds: 9
H-donors: 4
H-acceptors: 9
PSA: 174
Number of rings: 3

     

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