COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550982
Chemical Name: N~2~-[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]isoleucinamide
Smiles: COCc1[nH]nc(n1)NC(=O)C(C(CC)C)Nc1ccc2c(cc1=O)C(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C

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Molecular Weight: 608.69
Empirical Formula: C31H40N6O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.445
Rotatable bonds: 10
H-donors: 4
H-acceptors: 7
PSA: 165
Number of rings: 4

     

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