384 lines (377 with data), 12.8 kB
1nlo_ligand
Created by X-TOOL on Fri Sep 26 17:34:13 2014
178184 0 0 0 0 0 0 0 0999 V2000
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M END
> <MOLECULAR_FORMULA>
C63H94N11O10
> <MOLECULAR_WEIGHT>
1164.7
> <NUM_HB_ATOMS>
14
> <NUM_ROTOR>
23
> <XLOGP2>
3.74
$$$$