COc1cc(NCCCC[C@@H](C)NC(C)C)c2ncccc2c1    mol4431    0_1
COc1cc(NCCCC[C@@H](C)NC(C)C)c2[nH+]cccc2c1    mol4431    1_1
COc1cc(NCCCC[C@@H](C)[NH2+]C(C)C)c2ncccc2c1    mol4431    1_2
COc1cc([NH2+]CCCC[C@@H](C)NC(C)C)c2ncccc2c1    mol4431    1_3