Mrv1652304272019212D 13 14 0 0 0 0 999 V2000 -4.4274 0.4227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6428 0.6776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0297 0.1256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9645 -1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2451 0.3805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7182 -0.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 0.7145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -0.1715 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 10 1 0 0 0 0 6 9 2 0 0 0 0 6 10 1 0 0 0 0 7 12 2 0 0 0 0 8 13 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 M END > CDB006026 > CDB > CCCCN1C=CC2=C1N=CC=C2 > InChI=1S/C11H14N2/c1-2-3-8-13-9-6-10-5-4-7-12-11(10)13/h4-7,9H,2-3,8H2,1H3 > COVJZVLBFHYCHJ-UHFFFAOYSA-N > C11H14N2 > 174.247 > 174.115698459 > 1 > 27 > 20.363015455035395 > 1 > 0 > 0 > 1 > 1-butyl-1H-pyrrolo[2,3-b]pyridine > 3.26 > 2.769372517333333 > -2.44 > 0 > 2 > 0 > 4.389401816884439 > 17.82 > 53.7105 > 3 > 1 > 6.40e-01 g/l > 1-butylpyrrolo[2,3-b]pyridine > 1 > CDB006026 > N-butyl-7-Azaindole $$$$