smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
C=CCOC[C@@]1(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O	96331926	DUMOJBFXLNPOEI-UEZCKYPQSA-N	382.362	-4.185	30	30	GAEC	
C=C[C@@H](O)C/C(=N/OS(=O)(=O)O)S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O	13525761	MYHSVHWQEVDFQT-KBHNZSCUSA-N	389.404	-2.411	30	30	GAEC	
N#CCCOC[C@@]1(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O	113286250	DESQFPFZXXVYTB-UEZCKYPQSA-N	395.361	-4.458	30	30	GAEC	
Nc1ncnc2c1nc(N/N=C/c1cccnc1)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O	8636778	YAVGDTPEUHQIRH-SBFYAZMCSA-N	386.372	-1.139	30	30	GAEC	
O=C(/C=C/c1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)[nH]c1=O)ON1C(=O)CCC1=O	97973535	UCFQDCCIRGUDBE-OJJONNAYSA-N	395.324	-2.202	30	30	GAEC	
CN1C(N)=NS(=O)(=O)N=C1NCCSCc1csc(N=C(N)N)n1	4217611	FSWCCDQGXZITPD-UHFFFAOYSA-N	391.508	-1.268	30	30	GAEC	in-man
O=S(=O)(O)O/N=C(/Cc1ccccc1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O	96332247	SHVZLYAARRDYCX-QXIQELQBSA-N	377.371	-1.753	30	30	GAEC	
C/N=C(\N/N=C(C)/C(C)=N/N/C(=N\C)NS(C)(=O)=O)NS(C)(=O)=O	111903410	XDZBMQCXSUNZKF-FNCQTZNRSA-N	382.472	-2.013	30	30	GAEC