CCCCNc1ccnc(S)n1    mol4115    0_1
CCCC[NH2+]c1ccnc([S-])n1    mol4115    0_2
CCCCNc1ccnc(S)[nH+]1    mol4115    1_1
CCCC[NH2+]c1ccnc(S)n1    mol4115    1_2
CCCCNc1cc[nH+]c(S)n1    mol4115    1_3
CCCCNc1ccnc([S-])n1    mol4115    -1_1