c1cc(c2c3c1C[C@@H]4[C@]5([C@]3(CCN4CC6CCC6)C(O2)C(CC5)O)O)O.Cl SAM001247063
CCN1CCC[C@H]1CNC(=O)c2c(c(cc(c2OC)Cl)Cl)O SAM001247072
COc1cc(c(cc1C(=O)NC2CN3CCC2CC3)Cl)N.O.Cl SAM001247069
CN1CCc2cc(c(cc2C(C1)c3ccccc3)O)Br.Br SAM001247068
c1nc(c2c(n1)n(cn2)[C@H]3[C@H](C[C@H](O3)CO)O)N.O SAM001246964
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)Nc1ccc(cc1)O SAM001246965
CC[C@H]1[C@H](COC1=O)Cc2cncn2C.Cl SAM001246962
CC1=C(C(/C(=C(\O)/OC)/C(=N1)C)c2ccccc2[N+](=O)[O-])C(=O)OC SAM001246963
CC(c1ccc(c(c1)F)c2ccccc2)C(=O)O SAM001246961
Cc1c(c(=O)ccn1C)O SAM001247015
CN1CCN(CC1)C2=Nc3ccccc3Oc4c2cc(cc4)Cl.C(CC(=O)O)C(=O)O SAM001247061
CN1CC[C@@]23CCCC[C@@H]2[C@@H]1Cc4c3cc(cc4)OC.O.Br SAM001247062
CNCC[C@@H](c1cccs1)Oc2cccc3c2cccc3 SAM001247059
CC(=O)SCC(Cc1ccccc1)C(=O)NCC(=O)OCc2ccccc2 SAM001247060
c1ccc(c(c1)CC(=O)O[Na])Nc2c(cccc2Cl)Cl SAM001247057
CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C SAM001247039
c1c(nc(s1)NC(=N)N)CSCCC(=N)NS(=O)(=O)N SAM001247033
c1cc(nc(c1)Cl)N2CCC(CC2)N.Cl SAM001246999
CC(=O)O[C@H]1C[C@@H]2CCC3[C@@H](C2(CC1[N+]4(CCCCC4)C)C)CCC5([C@H]3CC(C5OC(=O)C)[N+]6(CCCCC6)C)C.[Br-] SAM001247003
Cc1ncc(n1CCO)[N+](=O)[O-] SAM001247010
CN1[C@@H]2CC(C[C@H]1[C@H]3[C@@H]2O3)OC(=O)[C@H](CO)c4ccccc4.O.Br SAM001246967
CC(C)C(CCCN(C)CCc1ccc(c(c1)OC)OC)(C#N)c2ccc(c(c2)OC)OC.O.Cl SAM001246968
C[C@H](Cc1ccccc1)N(C)CC#C.Cl SAM001246969
CC(C)/C=C\CCCCC(=O)NCc1ccc(c(c1)OC)O SAM001246970
CC(C)(C)NCC(c1ccc(c(c1)CO)O)O.OS(=O)(=O)O SAM001246971
c1ccc(cc1)C2CCN(CC2)[C@@H]3CCCC[C@H]3O.Cl SAM001246972
CC(=C)[C@@H]1[C@@H]2[C@@H]3[C@@]4([C@]([C@H]1C(=O)O2)(C[C@@H]5[C@]4(O5)C(=O)O3)O)C.C[C@@]12[C@H]3[C@H]4[C@H]([C@@H]([C@@]1(C[C@@H]5[C@]2(O5)C(=O)O3)O)C(=O)O4)C(C)(C)O SAM001246993
COc1cc2c(cc1OC)nc(nc2N)N3CCN(CC3)C(=O)C4CCCO4.O.Cl SAM001247000
c1ccc(cc1)c2c(c2=O)c3ccccc3 SAM001247027
C1[C@H](NC(=O)S1)C(=O)O SAM001247016
CN1CCCCC1CCN2c3ccccc3Sc4c2cc(cc4)S(=O)C.c1ccc(cc1)S(=O)(=O)O SAM001247051
COc1cc(ccc1OC(F)F)c2ccc(nn2)O SAM001247053
CN1CCN(CC1)CCCN2c3ccccc3Sc4c2cc(cc4)Cl.C(=C\C(=O)O)\C(=O)O SAM001247054
C1CCc2c(c(c3c(n2)CCC3)N)C1 SAM001247055
c1ccc(cc1)C(c2ccccc2)(c3ccccc3Cl)n4ccnc4 SAM001247056
CCOC(=O)N1CCC(=C2c3ccc(cc3CCc4c2nccc4)Cl)CC1 SAM001246987
c1ccc(cc1)CCNN.OS(=O)(=O)O SAM001247037
c1cc2c(cc1OC(F)(F)F)sc(n2)N.Cl SAM001246997
c1ccc2c(c1)c3c([nH]2)[C@H]4[C@@]56CCN(C([C@@]5(C3)O)Cc7c6c(c(cc7)O)O4)CC8CC8.O.Cl SAM001247004
c1cc(cnc1)C2CCCN2 SAM001247026
CNCCCCOc1ccccc1Cc2ccccc2.Cl SAM001247052
c1cc(oc1)c2nc3c4cc(ccc4nc(n3n2)N)Cl SAM001246973
CN(C)CCCSc1ccccc1NC(=O)/C=C/c2ccccc2.O.Cl SAM001246974
COc1cc(c(cc1C(=O)N[C@@H]2CCN(C[C@@H]2OC)CCCOc3ccc(cc3)F)Cl)N.O SAM001246975
CN[C@@H]1C[C@H](c2c1cccc2)c3ccc(c(c3)Cl)Cl.Cl SAM001246981
c1ccn2c(c1)nn(c2=O)CCCN3CCN(CC3)c4cccc(c4)Cl.Cl SAM001247045
COc1cc2c(cc1OC)nc(nc2N)N3CCN(CC3)C(=O)c4ccco4.O.Cl SAM001246995
Cn1c(cc(=O)n(c1=O)C)NCCCN2CCN(CC2)c3ccccc3OC.Cl SAM001247001
CN1[C@@H](CCC1=O)c2cccnc2 SAM001247007
C1[C@H](C(=O)NO1)N SAM001247014
COCCCCC(=NOCCN)c1ccc(cc1)C(F)(F)F.C(=C\C(=O)O)\C(=O)O SAM001246977
CN(C)CC/C=C\1/c2ccccc2COc3c1cccc3.Cl SAM001246976
CN1CCN(CC1)CCCN2c3ccccc3Sc4c2cc(cc4)C(F)(F)F.Cl SAM001247046
CN1CC[C@@]23CCCC[C@@H]2[C@@H]1Cc4c3cc(cc4)O.C(C(C(=O)O)O)(C(=O)O)O SAM001247023
CC(=O)O.CN=C(N)NCCC[C@@H](C(=O)O)N SAM001247049
CNCCCC12CCC(c3c1cccc3)c4c2cccc4.Cl SAM001246989
CN1CCC(=C2c3ccccc3CCc4c2ccs4)CC1.C(=C\C(=O)O)\C(=O)O SAM001247038
C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1CC[C@@H]2O)O SAM001247032
CC(=O)NCCCCCCNC(=O)C SAM001247019
CN(C)CCOC(c1ccccc1)c2ccccc2.Cl SAM001247024
CN1CC[C@@]23C=C[C@@H](C[C@@H]2Oc4c3c(ccc4OC)C1)O.Br SAM001246978
CC(C(c1ccc(cc1)O)O)N2CCC(CC2)Cc3ccccc3.C(C(C(=O)O)O)(C(=O)O)O.O SAM001246980
CCN(CC)C(=S)SSC(=S)N(CC)CC SAM001247028
c1cnc(nc1)N2CCN(CC2)Cc3ccc4c(c3)OCO4.O.Cl SAM001246994
CC(=O)N1CCN(CC1)c2ccc(cc2)OC[C@H]3CO[C@](O3)(Cn4ccnc4)c5ccc(cc5Cl)Cl SAM001246983
CN(C)CCN(Cc1ccccc1)c2ccccn2.Cl SAM001247047
c1(c(nc(c(n1)Cl)N)N)C(=O)NC(=N)N.O.Cl SAM001246996
c1ccc2c(c1)c(c3c(n2)CCCC3)N.Cl SAM001247002
C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1CC[C@]2(C#C)O)O SAM001247008
c1cn(c(=O)nc1N)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)O SAM001247012
CN(Cc1cnc2c(n1)c(nc(n2)N)N)c3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O.O SAM001246985
c1cc(cc(c1)N2CCNCC2)C(F)(F)F.Cl SAM001247043
CCCN[C@H]1CCc2c(sc(n2)N)C1 SAM001247006
CCN(CC)CC(=O)Nc1c(cccc1C)C SAM001247018
Cc1c(c2cc(ccc2n1C(=O)c3ccc(cc3)Cl)OC)CC(=O)O.O SAM001246982
CCCc1c(ccc(c1O)C(=O)C)OCCCCc2n[nH]nn2 SAM001246988
c1cc(ccc1[C@@H]2CCNC[C@H]2COc3ccc4c(c3)OCO4)F.C(=C\C(=O)O)\C(=O)O SAM001246991
c1c(cc(c(c1O)O)O)[C@@H]2[C@@H](Cc3c(cc(cc3O2)O)O)OC(=O)c4cc(c(c(c4)O)O)O SAM001247031
c1cc(c(cc1N)C(=O)O)O SAM001247020
CCOC(=O)C1(CO1)CCCCCCOc2ccc(cc2)Cl SAM001247025
CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](c3ccccc3)N)SC1)C(=O)O SAM001246761
C1CC(=O)N[C@@H]1C(=O)N2CSC[C@H]2C(=O)O SAM001246762
CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N2[C@H]3CCC[C@H]3C[C@H]2C(=O)O SAM001246757
C[N+]1(CCCCC1)CCC(c2ccccc2)(c3ccccc3)C(=O)N.[Br-] SAM001246642
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC(=O)CC[C@H]34 SAM001246751
CN/C(=C\[N+](=O)[O-])/NCCSCc1csc(n1)CN(C)C SAM001246752
c1c(c(nc(n1)O)N)F SAM001246753
c1ccc2c(c1)CC(=O)c3ccccc3N2C(=O)N SAM001246754
COc1cc(cc(c1OC)OC)C(=O)NC2CCCNC2 SAM001246756
CC(=O)Nc1ccc(cc1)CC(=O)O SAM001246647
CN1CCCC(CC1)n2c(=O)c3ccccc3c(n2)Cc4ccc(cc4)Cl.Cl SAM001246645
Cc1cccc(c1NC(=O)C(C)N)C SAM001246759
c1cc(c(cc1[C@@H]2[C@@H](C(=O)c3c(cc(cc3O2)O)O)O)O)O SAM001246760
C[C@H]1COc2c3n1cc(c(=O)c3cc(c2N4CCN(CC4)C)F)C(=O)O SAM001246758
CC(CO)O.c1cc(ccc1[C@H](C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)CSc4c[nH]nn4)C(=O)O)N)O SAM001246643
CC1=C(C(=O)C(=C(C1=O)OC)OC)CCCCCCCCCCO SAM001246700
CCN1CCC[C@H]1CNC(=O)c2cc(ccc2OC)S(=O)(=O)N SAM001246703
c1ccc(cc1)C2C(=O)N=C(O2)N SAM001246706
c1cc(ccc1C#N)C(c2ccc(cc2)C#N)n3cncn3 SAM001246649
C[C@@H]1[C@@H]2[C@H](C(=O)N2C(=C1S[C@H]3C[C@H](NC3)C(=O)N(C)C)C(=O)O)[C@@H](C)O SAM001246650
CCCCCCCCCCC[C@@H](C[C@H]1[C@@H](C(=O)O1)CCCCCC)OC(=O)[C@H](CC(C)C)NC=O SAM001246637
Cc1nccn1CC2CCc3c(c4ccccc4n3C)C2=O.Cl SAM001246631
CC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC(=O)CC[C@H]34 SAM001246694
c1c(ccc(c1)OC(=O)[C@H]2CC[C@@H](CC2)CN)CCC(=O)O.Cl SAM001246695
Cc1nnc2n1-c3ccc(cc3C(=NC2)c4ccccc4)Cl SAM001246696
c1cc(c(c(c1)Cl)Cl)c2c(nc(nn2)N)N SAM001246697
CCN(c1ccccc1C)C(=O)/C=C/C SAM001246702
CC(C(=O)c1cccc(c1)Cl)NC(C)(C)C SAM001246699
CN(CCCNC(=O)C1CCCO1)c2nc3cc(c(cc3c(n2)N)OC)OC SAM001246638
CCN1CCCC1CNC(=O)c2cc(c(cc2OC)N)S(=O)(=O)CC SAM001246639
CN(CCCN1c2ccccc2CCc3c1cccc3)CC(=O)c4ccc(cc4)Cl.Cl SAM001246632
c1ccc2c(c1)c(ns2)N3CCN(CC3)CCCCN4C(=O)[C@@H]5CCCC[C@@H]5C4=O.Cl SAM001246688
CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@](C2(C)C)(C[C@@H]1OC(=O)[C@@H]([C@H](c5ccccc5)NC(=O)OC(C)(C)C)O)O)OC(=O)c6ccccc6)(CO4)OC(=O)C)O)C)O SAM001246689
C=CCc1ccc(c(c1)c2ccc(c(c2)CC=C)O)O SAM001246690
Cc1ccc(c(c1)[C@H](CCN(C(C)C)C(C)C)c2ccccc2)O.C(C(C(=O)O)O)(C(=O)O)O SAM001246691
CCCCCCNC(=O)n1cc(c(=O)[nH]c1=O)F SAM001246692
CN1CC[C@H]([C@@H](C1)COc2ccc3c(c2)OCO3)c4ccc(cc4)F SAM001246633
CCCc1nc(c(n1Cc2ccc(cc2)c3ccccc3c4n[nH]nn4)C(=O)O)C(C)(C)O SAM001246634
CCCCc1nc(c(n1Cc2ccc(cc2)c3ccccc3c4[n-]nnn4)CO)Cl.[K+] SAM001246635
Cn1c(=O)n2cnc(c2nn1)C(=O)N SAM001246636
C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C)O)C SAM001246682
Cc1ccc(cc1)S(=O)(=O)O.c1cc(c(cc1F)F)n2cc(c(=O)c3c2nc(c(c3)F)N4CCC(C4)N)C(=O)O SAM001246686
CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)N=CN3CCCCCC3)C(=O)O)C SAM001246687
Cc1ccccc1O[C@H](CCNC)c2ccccc2.Cl SAM001246626
C[C@@H]1CC[C@H]2[C@H]([C@H](O[C@H]3[C@@]24[C@H]1CC[C@](O3)(OO4)C)OC(=O)CCC(=O)O)C SAM001246628
CCC(C)n1c(=O)n(cn1)c2ccc(cc2)N3CCN(CC3)c4ccc(cc4)OCC5COC(O5)(Cn6cncn6)c7ccc(cc7Cl)Cl SAM001246679
CC(C)OC(=O)OC(C)OC(=O)C1=C(CS[C@H]2N1C(=O)[C@H]2NC(=O)C(=NOC)c3csc(n3)N)COC SAM001246674
COc1cc(c(c(c1)OC)C(=O)CCCN2CCCC2)OC.Cl SAM001246680
c1cc(ccc1C(=O)NCCN2CCOCC2)Cl SAM001246614
C[C@@H]1C[C@H]2[C@@H]3C[C@@H](C4=CC(=O)C(=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)F)C)Cl)F SAM001246616
CSc1[nH]c2cc(c(cc2n1)Cl)Oc3cccc(c3Cl)Cl SAM001246681
CS(=O)(=O)c1ccc(cc1)C2=C(C(=O)OC2)c3ccccc3 SAM001246617
CC(C)NCC(COc1ccc(cc1)COCCOC(C)C)O.C(=C/C(=O)O)\C(=O)O SAM001246618
c1cc(ccc1[C@@H]2[C@H](C(=O)N2c3ccc(cc3)F)CC[C@@H](c4ccc(cc4)F)O)O SAM001246623
Cc1ccsc1C(=CCCN2CCC[C@H](C2)C(=O)O)c3c(ccs3)C.Cl SAM001246625
C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](Cc3c2c(c4c(c3O)C(=O)c5ccccc5C4=O)O)(C(=O)C)O)N)O.Cl SAM001246676
COC(=O)Nc1[nH]c2ccc(cc2n1)C(=O)c3ccc(cc3)F SAM001246685
C[C@@H]1C[C@@H]([C@@H]2[C@H](C[C@H]([C@@](O2)(C(=O)C(=O)N3CCCC[C@H]3C(=O)O[C@@H]([C@@H]([C@H](CC(=O)[C@@H](C=C(C1)C)CC=C)O)C)/C(=C/[C@@H]4CC[C@H]([C@@H](C4)OC)O)/C)O)C)OC)OC SAM001246677
CC(C)[C@@H](C(=O)OCCOCn1cnc2c1nc(nc2O)N)N.Cl SAM001246749
CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)OC)C)C)O)(C)O SAM001246748
c1cc(c(c(c1)Cl)Cl)N2CCN(CC2)CCCCOc3ccc4c(c3)NC(=O)CC4 SAM001246750
CCC(COC(=O)c1cc(c(c(c1)OC)OC)OC)(c2ccccc2)N(C)C.C(=C\C(=O)O)\C(=O)O SAM001246747
C[C@]12CCC(=O)C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C)O)C SAM001246746
CC1=C(C(/C(=C(\O)/OC)/C(=N1)C)c2ccccc2[N+](=O)[O-])C(=O)OCC(C)C SAM001246719
c1cc(ccc1/C=C/c2cc(cc(c2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O SAM001246720
Cc1ncc(n1CC(C)O)[N+](=O)[O-] SAM001246716
Cn1c(cc(=O)n(c1=O)C)NCCN(CCCc2ccc(cc2)[N+](=O)[O-])CCO.Cl SAM001246717
CC([C@H]1CC[C@@H](CC1)C(=O)N[C@@H](C(=O)O)Cc2ccccc2)C SAM001246721
CC1=C[C@@H]2[C@H](CC[C@]3([C@H]2CC[C@@]3(C(=O)C)OC(=O)C)C)[C@@]4(C1=CC(=O)CC4)C SAM001246722
Cc1cc(c(cc1Cc2cnc(nc2N)N)OC)OC SAM001246728
CC(c1cc2ccccc2s1)N(C(=O)N)O SAM001246738
Cc1cn(c(=O)[nH]c1=O)[C@H]2C=C[C@H](O2)CO SAM001246729
CCOC(=O)c1ccc(cc1)OC(=O)CCCCCN=C(N)N.CS(=O)(=O)O SAM001246730
c1cc(c(cc1Cl)Cl)CON=C(Cn2ccnc2)c3ccc(cc3Cl)Cl.[N+](=O)(O)[O-] SAM001246724
C[C@@H]1CC=CC=C[C@@H]([C@@H](C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O1)OC(=O)C)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)O)(C)OC(=O)CC(C)C)N(C)C)O)CC=O)C)O SAM001246731
CC(=O)OCC(CCn1cnc2c1nc(nc2)N)COC(=O)C SAM001246732
CC(C)NCC(c1ccc(cc1)NS(=O)(=O)C)O.Cl SAM001246725
CN1CCN(CC1)c2c(cc3c4c2SCCn4cc(c3=O)C(=O)O)F SAM001246726
c1cc(c(cc1[C@@H]2[C@H](C(=O)c3c(cc(cc3O2)O)O)O)O)O SAM001246778
Cc1c(nc[nH]1)CN2CCc3c(c4ccccc4n3C)C2=O.Cl SAM001246782
CC(C(=O)c1cccc(c1)Cl)NC(C)(C)C.Cl SAM001246723
c1cc(c(cc1Cl)c2nc(nc(n2)N)N)Cl.C(=C\C(=O)O)\C(=O)O SAM001246718
C[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2O)O)O[C@@H]3[C@H](OC([C@@H]([C@H]3O)O)O)CO)CO)O)O)N[C@H]4C=C([C@H]([C@@H]([C@H]4O)O)O)CO SAM001246733
CC(COc1ccccc1Cc2ccccc2)N3CCCCC3.OP(=O)(O)O SAM001246739
c1ccc(cc1)CCCOC(=O)N SAM001246740
C[C@@]12C[C@H]3C[C@@](C1)(C[C@](C3)(C2)N)C.Cl SAM001246743
COc1ccccc1OCCNCC(COc2cccc3c2c4ccccc4[nH]3)O SAM001246736
CC(=O)CCCCn1cnc2c1c(=O)n(c(=O)n2C)C SAM001246741
C[C@H]1COc2c(c(cc3c2n1cc(c3=O)C(=O)O)F)C4(CC4)N SAM001246742
C1[C@@H]([C@H]([C@@H]([C@H](N1CCO)CO)O)O)O SAM001246745
COc1ccc(cc1OC)/C=C/C(=O)Nc2ccccc2C(=O)O SAM001246737
Cc1cc2c(s1)Nc3ccccc3N=C2N4CCN(CC4)C SAM001246652
CCc1nn(c(=O)n1CCOc2ccccc2)CCCN3CCN(CC3)c4cccc(c4)Cl.Cl SAM001246653
COc1c2c(cc(c1N3C[C@@H]4CCCN[C@@H]4C3)F)c(=O)c(cn2C5CC5)C(=O)O.Cl SAM001246654
Cc1c(cccc1O)C(=O)N[C@@H](CSc2ccccc2)[C@@H](CN3C[C@H]4CCCC[C@H]4C[C@H]3C(=O)NC(C)(C)C)O.CS(=O)(=O)O SAM001246655
CC[C@H](C)C(=O)O[C@H]1C[C@@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@H](C[C@H](CC(=O)[O-])O)O)O.[Na+] SAM001246656
CC[C@@]1(c2cc-3n(c(=O)c2COC1=O)Cc4c3nc5ccc(c(c5c4)CN(C)C)O)O.Cl SAM001246651
CC[C@@H](C(=O)N)N1CCCC1=O SAM001246539
CCCN[C@H]1CCc2c(sc(n2)N)C1.Cl SAM001246540
Cc1c(c(=O)n2c(n1)CCCC2)CCN3CCC(CC3)c4c5ccc(cc5on4)F SAM001246595
CCc1ccc(nc1)CCOc2ccc(cc2)CC3C(=O)NC(=O)S3.Cl SAM001246600
CC1(C[C@@H]1C(=O)N/C(=C\CCCCSC[C@@H](C(=O)O)N)/C(=O)[O-])C.[Na+] SAM001246552
C[C@@H]1CCN([C@H](C1)C(=O)O)C(=O)[C@H](CCCN=C(N)N)NS(=O)(=O)c2cccc3c2NCC(C3)C SAM001246661
Cc1c(c(no1)c2ccccc2)c3ccc(cc3)S(=O)(=O)N SAM001246603
COc1ccccc1N2CCN(CC2)CC(COc3cccc4c3cccc4)O SAM001246658
COc1ccc(cc1OC)c2cc(=O)c3c(o2)c(c(c(c3OC)OC)OC)OC SAM001246662
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)NC(C)(C)C)CC[C@@H]4[C@@]3(C=CC(=O)N4)C SAM001246541
Cc1ccc(cc1)c2c(n3cc(ccc3n2)C)CC(=O)N(C)C.C(C(C(=O)O)O)(C(=O)O)O SAM001246549
Cc1ccnc2c1NC(=O)c3cccnc3N2C4CC4 SAM001246551
CC1(O[C@@H]2CO[C@@]3([C@H]([C@@H]2O1)OC(O3)(C)C)COS(=O)(=O)N)C SAM001246601
C[C@@H](c1c(cncn1)F)[C@](Cn2cncn2)(c3ccc(cc3F)F)O SAM001246664
CS(=O)(=O)O.c1cc(ccc1C2CNCCc3c2cc(c(c3Cl)O)O)O SAM001246665
CN(CCOc1ccc(cc1)CC2C(=O)NC(=O)S2)c3ccccn3.C(=C\C(=O)O)\C(=O)O SAM001246610
CN(C)CCC[C@@]1(c2ccc(cc2CO1)C#N)c3ccc(cc3)F.C(=O)(C(=O)O)O SAM001246668
CC1CCC[C@@H](CCCCCc2cc(cc(c2C(=O)O1)O)O)O SAM001246609
CC(C)OC(=O)CCC/C=C\C[C@H]1[C@H](C[C@H]([C@@H]1CC[C@H](CCc2ccccc2)O)O)O SAM001246671
c1nc2c(c(n1)O)ncn2[C@H]3CC[C@H](O3)CO SAM001246673
CN[C@H]1CC[C@H](c2c1cccc2)c3ccc(c(c3)Cl)Cl.Cl SAM001246666
C[C@H](/C=C/[C@H](C1CC1)O)[C@H]2CC[C@@H]\3[C@@]2(CCC/C3=C\C=C/4\C[C@H](C[C@@H](C4=C)O)O)C SAM001246670
C[C@H]1[C@@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](Cc3c2c(c4c(c3O)C(=O)c5cccc(c5C4=O)OC)O)(C(=O)CO)O)N)O.Cl SAM001246559
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O SAM001246612
CC1=C([C@@H](/C(=C(\O)/OC)/C(=N1)C)c2cccc(c2)[N+](=O)[O-])C(=O)O[C@@H]3CCCN(C3)Cc4ccccc4.Cl SAM001246672
CC(C)c1ccc2c(c1)c(=O)c3cc(c(nc3o2)N)C(=O)O SAM001246669
CC(C)c1c(c(c(c(n1)C(C)C)/C=C/[C@H](C[C@H](CC(=O)[O-])O)O)c2ccc(cc2)F)COC.[Na+] SAM001246554
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)Oc2c(=O)c3c(cc(c(c3oc2c4ccc(cc4)OC)CC=C(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O)O)O SAM001246560
C[C@]12CC[C@@H](CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C)O)C)O SAM001246562
CC(C)[C@@]12[C@@H](O1)[C@H]3[C@@]4(O3)[C@]5(CCC6=C([C@@H]5C[C@H]7[C@]4([C@@H]2O)O7)COC6=O)C SAM001246553
CN(CCOc1ccc(cc1)CC2C(=O)NC(=O)S2)c3ccccn3.Cl SAM001246608
c1c(c(=O)[nH]c(=O)n1C2CCCO2)F SAM001246561
CC[C@H]1CC[C@@H]2[C@@H]([C@@H]([C@H]([C@@]3(O2)CC[C@H]([C@H](O3)C[C@H](C)O)C)C)OC(=O)C=C[C@H]([C@@H]([C@H](C(=O)[C@H]([C@@H]([C@H](C(=O)[C@@H]([C@@H]([C@H](CC=CC=C1)C)O)C)C)O)C)C)O)C)C SAM001246769
CCOC(=O)[C@H](CCc1ccccc1)N[C@H]2CCc3ccccc3N(C2=O)CC(=O)O.Cl SAM001246712
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CC[C@@H]4[C@@]3(CC(=C(C4)O)C=O)C SAM001246765
CC(C)Oc1ccc2c(c1)occ(c2=O)c3ccccc3 SAM001246714
c1ccc(cc1)c2c(oc(n2)CCC(=O)O)c3ccccc3 SAM001246770
COc1ccc(cc1OC2CCCC2)C3CC(=O)NC3 SAM001246766
CCOc1cc(c(cc1C(=O)NCC2CN(CCO2)Cc3ccc(cc3)F)Cl)N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O SAM001246713
c1cc(c(cc1c2c(c(=O)c3c(cc(cc3o2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O SAM001246767
CCOC(=O)c1c2n(cn1)-c3ccc(cc3C(=O)N(C2)C)F SAM001246763
c1cc(ccc1Cn2ccnc2)/C=C/C(=O)O.Cl SAM001246593
c1cc(c(cc1c2c(c(=O)c3c(cc(cc3o2)O)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)O)O SAM001246776
Cc1c(c2c3c4c1O[C@@](C4=O)(OC=C[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]([C@H](C=CC=C(C(=O)Nc(c2O)c5=NC6(CCN(CC6)CC(C)C)N=c35)C)C)O)C)O)C)OC(=O)C)C)OC)C)O SAM001246589
CC(C)NCC(COc1ccc(cc1)CCC(=O)OC)O.Cl SAM001246533
CN1CC(=O)N2[C@@H](C1=O)Cc3c4ccccc4[nH]c3[C@H]2c5ccc6c(c5)OCO6 SAM001246586
c1ccc(cc1)C(c2ccccc2)S(=O)CC(=O)N SAM001246587
C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](Cc3c2c(c4c(c3O)C(=O)c5cccc(c5C4=O)OC)O)(C(=O)CO)O)N)O.Cl SAM001246768
Cc1nc(c(c(n1)Cl)NC2=NCCN2)OC.Cl SAM001246764
c1ccc(cc1)C2=NCC(=O)Nc3c2cc(cc3)[N+](=O)[O-] SAM001246711
CCn1cc(c(=O)c2c1cc(c(c2)F)N3CCN(CC3)C)C(=O)O.CS(=O)(=O)O SAM001246571
CN(C)CC(c1ccc(cc1)OC)C2(CCCCC2)O.Cl SAM001246572
COc1ccnc(c1OC)CS(=O)c2[n-]c3ccc(cc3n2)OC(F)F.[Na+] SAM001246591
CCC(=O)O[C@@]1([C@@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2C[C@@H](C4=CC(=O)C=C[C@@]43C)F)F)O)C)C)C(=O)SCF SAM001246583
CC(C)(C)NC(=O)[C@@H]1CN(CCN1C[C@H](C[C@@H](Cc2ccccc2)C(=O)N[C@H]3c4ccccc4C[C@H]3O)O)Cc5cccnc5.OS(=O)(=O)O SAM001246588
Cc1ncc2n1-c3ccc(cc3C(=NC2)c4ccccc4F)Cl.Cl SAM001246585
c1cn(c(=O)nc1N)[C@@H]2CS[C@@H](O2)CO SAM001246582
CC(C)NC(=O)c1ccc(cc1)CNNC.Cl SAM001246564
Cc1cnc(c(c1OC)C)CS(=O)c2nc3cc(ccc3n2[Mg]n4c5ccc(cc5nc4S(=O)Cc6c(c(c(cn6)C)OC)C)OC)OC SAM001246538
c1ccnc(c1)NS(=O)(=O)c2ccc(cc2)N=Nc3ccc(c(c3)C(=O)O)O SAM001246530
Cc1cccc(c1)Nc2ccncc2S(=O)(=O)NC(=O)NC(C)C SAM001246567
CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(=O)c3c[nH]c4c3cccc4.Cl SAM001246576
Cc1cccc(c1NC(=O)CN2CCN(CC2)CC(COc3ccccc3OC)O)C.Cl SAM001246534
CCO/C(=C\1/C(C(=C(N=C1C)C)C(=O)OC)c2cccc(c2)[N+](=O)[O-])/O SAM001246531
CC(C)(C)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2CN1C[C@H]([C@H](Cc3ccccc3)NC(=O)[C@H](CC(=O)N)NC(=O)c4ccc5ccccc5n4)O.CS(=O)(=O)O SAM001246578
c1ccc(cc1)c2ccc(cc2)C(c3ccccc3)n4ccnc4 SAM001246775
CNS(=O)(=O)Cc1ccc2c(c1)c(c[nH]2)CCN(C)C.C(CC(=O)O)C(=O)O SAM001246579
C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC(=C)C4=CC(=O)C=C[C@]34C SAM001246574
CC(=O)Oc1ccccc1C(=O)Nc2ncc(s2)[N+](=O)[O-] SAM001246708
CN1c2ccc(cc2C(=NCC1=O)c3ccccc3)Cl SAM001246536
c1ccc2c(c1)C(=Nc3ccccc3S2)N4CCN(CC4)CCOCCO.C(=C/C(=O)O)\C(=O)O SAM001246777
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)Oc3c(=O)c4c(cc(cc4oc3c5ccc(c(c5)O)O)O)O)O)O)O)O)O)O SAM001246528
c1nc2c(n1CCC(CO)CO)nc(nc2O)N SAM001246580
C[C@H](CCCC(C)(C)O)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C SAM001246772
CCOC(=O)C1(CCN(CC1)CCC(C#N)(c2ccccc2)c3ccccc3)c4ccccc4.Cl SAM001246532
c1ccc(cc1)C(COC(=O)N)COC(=O)N.O SAM001247005
c1ccc2c(c1)nc(n2C3=CCN(CC3)CCCC(=O)c4ccc(cc4)F)O SAM001247013
CC(=O)CCCCn1c(=O)c2c(ncn2C)n(c1=O)C SAM001247011
c1ccc(cc1)C(=O)c2ccc3n2CCC3C(=O)O.C(C(CO)(CO)N)O SAM001246596
CC(C)c1nc(cs1)CN(C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc2ccccc2)C[C@@H]([C@H](Cc3ccccc3)NC(=O)OCc4cncs4)O SAM001246783
CCC1=C[C@@H]2C[C@@](c3c(c4ccccc4[nH]3)CN(C2)C1)(c5cc6c(cc5OC)N([C@@H]7[C@]68CCN9[C@H]8[C@@](C=CC9)([C@H]([C@@]7(C(=O)OC)O)OC(=O)C)CC)C)C(=O)OC.C(C(C(=O)O)O)(C(=O)O)O SAM001246780
CC(=O)NC[C@H]1CN(C(=O)O1)c2ccc(c(c2)F)N3CCOCC3 SAM001246624
COc1ccc(c(c1OC)OC)CN2CCN(CC2)C(c3ccc(cc3)F)c4ccc(cc4)F.Cl SAM001246727
c1cc2c(cc1Cl)[C@@](OC(=O)N2)(C#CC3CC3)C(F)(F)F SAM001246667
CCCCC1=NC2(CCCC2)C(=O)N1Cc3ccc(cc3)c4ccccc4c5n[nH]nn5 SAM001246548
CCOc1cc(ccc1C(=O)O)CC(=O)N[C@@H](CC(C)C)c2ccccc2N3CCCCC3 SAM001246546
CC[C@@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CCCC[C@H]34)C)O SAM001246555
COc1cc(cc(c1)OC)/C=C/c2ccc(cc2)O SAM001246605
CC(=O)OCC(=O)NCCCOc1cccc(c1)CN2CCCCC2.Cl SAM001246547
CN(C)CC[C@@H](c1ccc(cc1)Br)c2ccccn2.C(=C\C(=O)O)\C(=O)O SAM001246556
c1cc(c(c2c1N=C3NC(=O)CN3C2)Cl)Cl.Cl SAM001246604
CCCCCN=C(N)NN=Cc1c[nH]c2c1cc(cc2)OC.C(=C\C(=O)O)\C(=O)O SAM001246606
Cc1c(cc(c(n1)O)C#N)c2ccncc2 SAM001246611
c1ccc(cc1)[C@H](c2ccc(cc2)Cl)N3CCN(CC3)CCOCC(=O)O SAM001246575
CN(C)CCCC1(c2ccc(cc2CO1)C#N)c3ccc(cc3)F.Br SAM001246599
c1ccc(c(c1)CN2CCc3c(ccs3)C2)Cl.Cl SAM001246558
CC(c1ccc(cc1)CC2CCCC2=O)C(=O)[O-].[Na+] SAM001246594
Cc1ccccc1S(=O)(=O)NC(=O)c2ccc(c(c2)OC)Cc3cn(c4c3cc(cc4)NC(=O)OC5CCCC5)C SAM001246577
CC(C)(C)C#C/C=C/CN(C)Cc1cccc2c1cccc2.Cl SAM001246565
CC1=C(C(/C(=C(\O)/OC)/C(=N1)C)c2cccc3c2non3)C(=O)OC(C)C SAM001246584
CCCCC(=O)N(Cc1ccc(cc1)c2ccccc2c3n[nH]nn3)[C@@H](C(C)C)C(=O)O SAM001246581
CN1C(=C(c2ccccc2S1(=O)=O)O)C(=O)Nc3ccccn3.O SAM001247048
C[N+]1(CCC(C1)OC(=O)C(c2ccccc2)(C3CCCC3)O)C.[Br-] SAM001246629
C[C@@]12CCN(C1N(c3c2cc(cc3)OC(=O)NC)C)C.OS(=O)(=O)O SAM001246992
CN1[C@@H](CCC[C@@H]1CC(=O)c2ccccc2)C[C@@H](c3ccccc3)O.Cl SAM001247050
CC(c1ccccc1)(c2ccccn2)OCCN(C)C.C(CC(=O)O)C(=O)O SAM001247030
CCN(CC)C(=O)[C@@]1(C[C@@H]1CN)c2ccccc2.Cl SAM001247035
c1c(cnc(n1)O)F SAM001247017
CN(C)CCC(c1ccc(cc1)Cl)c2ccccn2.C(=C\C(=O)O)\C(=O)O SAM001247022
CN(CCc1ccc(cc1)NS(=O)(=O)C)CCOc2ccc(cc2)NS(=O)(=O)C SAM001246621
C[C@@H](Cc1ccc(cc1)OC)NC[C@H](c2ccc(c(c2)NC=O)O)O.C(=C/C(=O)O)\C(=O)O.O SAM001246675
CN(C)CCc1c[nH]c2c1cc(cc2)Cn3cncn3.c1ccc(cc1)C(=O)O SAM001246615
Cc1c(c2c3c4c1O[C@@](C4=O)(OC=C[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]([C@H](C=CC=C(C(=O)Nc(c2O)c(c3O)C=NN5CCN(CC5)C6CCCC6)C)C)O)C)O)C)OC(=O)C)C)OC)C)O SAM001246620
CCOC(=O)O[C@@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)C=C[C@]34C)O)C)C(=O)OCCl SAM001246630
C[C@@H](C(=O)N1CCC[C@H]1C(=O)O)N[C@@H](CCc2ccccc2)C(=O)O SAM001246684
COc1cc2c(cc1OC)C(=O)C(C2)CC3CCN(CC3)Cc4ccccc4.Cl SAM001246627
CN1c2ccc(cc2C(=NCC1=O)c3ccccc3)[N+](=O)[O-] SAM001246755
c1cc(cnc1)C(=O)NCCO[N+](=O)[O-] SAM001246701
CCCc1nc2c(cc(cc2n1Cc3ccc(cc3)c4ccccc4C(=O)O)c5nc6ccccc6n5C)C SAM001246602
CN(C)CCOc1ccc(cc1)CNC(=O)c2ccc(c(c2)OC)OC.Cl SAM001246542
Cc1ccn2c(c1)nc3c2c4c(c5c3c6c(c(c5O)C)O[C@@](C6=O)(OC=C[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]([C@H](C=CC=C(C(=O)N4)C)C)O)C)O)C)OC(=O)C)C)OC)C)O SAM001246597
CC(C)(c1ccccc1CC[C@H](c2cccc(c2)/C=C/c3ccc4ccc(cc4n3)Cl)SCC5(CC5)CC(=O)[O-])O.[Na+] SAM001246657
c1cn(c(=O)nc1N)[C@H]2CC[C@H](O2)CO SAM001246779
c1cc(c(c(c1)Cl)NC2=NCCN2)Cl.Cl SAM001247073
CCN(CC)CC1CCCCN1CC(=O)N2c3ccccc3C(=O)Nc4c2nccc4 SAM001247077
CC(C)c1ccc2c(c1)c(c(n2Cc3ccc(cc3)Cl)CC(C)(C)C(=O)O)SC(C)(C)C SAM001247075
CCOC(=O)c1cncn1[C@H](C)c2ccccc2 SAM001247074
CC(Cc1ccccc1)(c2ccccc2)NC(=O)CN.Cl SAM001247078
c1ccc2c(c1)c(=O)n(c(=S)[nH]2)CCN3CCC(CC3)C(=O)c4ccc(cc4)F.O.Cl SAM001247080
CC(C)NCC(COc1ccc(cc1)CCOCC2CC2)O.Cl SAM001247084
c1ccc2c(c1)c(c([nH]2)O)C3=Nc4ccccc4C3=O SAM001246563
CN1c2cc(cc(c2OCC1=O)C(=O)NC3CN4CCC3CC4)Cl.Cl SAM001247082
COC(=O)N1CCN(C(C1)CN2CCCC2)C(=O)Cc3ccc(c(c3)Cl)Cl.C(=C/C(=O)O)\C(=O)O SAM001247087
C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)COC(=O)CCC(=O)[O-])O)CCC4=CC(=O)C=C[C@]34C)O.[Na+] SAM001246897
CC1=NS(=O)(=O)c2cc(ccc2N1)Cl SAM001246872
c1nc2c(nc(nc2n1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)Cl)N SAM001246886
Cc1ncc(n1CC(CCl)O)[N+](=O)[O-] SAM001246873
C[N+]1(CCN(CC1)c2ccccc2)C.[I-] SAM001246914
Cc1c(c(=O)n2ccccc2n1)CCN3CCC(CC3)C(=O)c4ccc(cc4)F SAM001246893
C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1CC[C@]2(C#C)O)OC SAM001246866
c1ccnc(c1)CCN SAM001246867
CCN(CC)CCOC(=O)C(c1ccccc1)(c2ccccc2)O.Cl SAM001246868
C(C(=O)O)(Cl)Cl SAM001246870
CC(C)C[C@@H](C(=O)O)NC(=O)[C@H]([C@@H](Cc1ccccc1)N)O SAM001246806
CN(C)CCOc1ccc(cc1)/C(=C(/CCCl)\c2ccccc2)/c3ccccc3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O SAM001246774
CC(C)CC(C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCCC1C(=O)NNC(=O)N)NC(=O)C(COC(C)(C)C)NC(=O)C(Cc2ccc(cc2)O)NC(=O)C(CO)NC(=O)C(Cc3c[nH]c4c3cccc4)NC(=O)C(Cc5c[nH]cn5)NC(=O)C6CCC(=O)N6.CC(=O)O SAM001246784
COc1cc(ccc1O)C[C@@H](CO)[C@@H](Cc2ccc(c(c2)OC)O)CO SAM001246678
Cc1nc2ccc(cc2c(n1)O)CN(C)c3ccc(s3)C(=O)N[C@@H](CCC(=O)O)C(=O)O SAM001246796
CCN1CC(C(C1=O)(c2ccccc2)c3ccccc3)CCN4CCOCC4.Cl SAM001246792
COc1ccc2c(c1)c(c[nH]2)C3=CCNCC3.C(CC(=O)O)C(=O)O SAM001247095
COc1cc2c(cc1OC)N3[C@@H]4[C@]25CCN6[C@H]5C[C@@H]7[C@H]4[C@H](CC3=O)OCC=C7C6 SAM001246865
c1ccc2c(c1)c3c([nH]2)CNCC3 SAM001246862
c1ccc2c(c1)N(c3cc(ccc3S2)C(F)(F)F)CCCN4CCN(CC4)CCO.Cl SAM001246863
c1cc2c3c(c1)C(=O)N(C[C@H]3CCC2)[C@@H]4CN5CCC4CC5.Cl SAM001246791
C[C@@H](c1ccc2cc(ccc2c1)OC)C(=O)[O-].[Na+] SAM001246874
Cc1cccc(c1NC(=O)C2CCCCN2C)C.Cl SAM001246875
CCc1c(c2ccccc2o1)C(=O)c3cc(c(c(c3)Br)O)Br SAM001246877
CC1=C(C(/C(=C(\O)/OCCOC)/C(=N1)C)c2cccc(c2)[N+](=O)[O-])C(=O)OC(C)C SAM001246890
C[C@]1(c2cccc(c2C(=O)C3=C([C@]4(C(CC31)[C@@H](C(=O)C(=C4O)C(=O)NCN5CCCC5)N(C)C)O)O)O)O SAM001246892
Cc1cc(nc(n1)n2c(cc(n2)C)OC)OC SAM001246891
c1c(=O)[nH]c(=O)n(n1)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O SAM001246876
CC12CCC(=O)C=C1CCC3C2CCC4(C3CCC4(C(=O)CO)O)C SAM001246889
c1cc(cnc1)CO SAM001246894
c1cc(ccc1C(=O)CCCN2CCC(CC2)(c3ccc(cc3)Cl)O)F.Cl SAM001246979
CC(C)(C)C(/C=C/c1ccc2c(c1)OCO2)O SAM001247042
CN1CCN(CC1)C2=Nc3cc(ccc3Cc4c2cccc4)F SAM001247034
CC[N+](C)(CC)CCOC(=O)C(c1ccccc1)(C2CCCCC2)O.[Br-] SAM001246887
COc1ccc(cc1OC)CCN SAM001246869
CCS(=O)(=O)CCn1c(ncc1[N+](=O)[O-])C SAM001246913
Cn1c2c(c(=O)n(c1=O)C)n(cn2)CC(CN(C)CCO)O.c1cc(cnc1)C(=O)O SAM001246912
CNCC(c1ccc(cc1)O)O SAM001246896
c1cc(ccc1/C=C/c2cc(cc(c2)O)O)O SAM001246888
Cc1c(c(=O)cco1)O SAM001246871
c1cc2c[nH]nc2cc1N SAM001246854
CCN1CCN(CC1)c2cc3c(cc2F)c(=O)c(cn3C4CC4)C(=O)O SAM001246856
C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(C(=O)C[C@H]3[C@H]2C(=O)C[C@H]4[C@@]3(CCC(=O)C4)C)C SAM001246857
c1ccc(cc1)[C@H](C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)Cl)C(=O)O)N SAM001246884
c1ccc(cc1)Cn2ccnc2 SAM001246858
CNCC[C@@H](c1cccs1)Oc2cccc3c2cccc3.Cl SAM001246523
CCCc1nc(c2n1nc(nc2O)c3cc(ccc3OCC)S(=O)(=O)N4CCN(CC4)CC)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O SAM001246573
CCCN1CCCC[C@H]1C(=O)Nc2c(cccc2C)C.Cl SAM001246524
CC(C)(C#N)c1cc(cc(c1)C(C)(C)C#N)Cn2cncn2 SAM001246525
CN1CCC(=C2c3ccccc3CC(=O)c4c2ccs4)CC1.C(=C/C(=O)O)\C(=O)O SAM001246984
C[C@H]1C[C@@H]2[C@H](CC[C@]3([C@H]2CC[C@@]3(C(=O)C)O)C)[C@@]4(C1=CC(=O)CC4)C SAM001246906
CC(C(C)(C)C)N=C(NC#N)Nc1ccncc1.O SAM001246907
c1cc2c[nH]nc2c(c1)[N+](=O)[O-] SAM001246908
COc1ccc2c(c1)c(c[nH]2)CCN SAM001246909
c1ccc2c(c1)Nc3ccccc3S2 SAM001246855
c1nc2c(nc(nc2n1[C@H]3C[C@@H]([C@H](O3)CO)O)Cl)N SAM001246526
Cn1c2ccccc2c(n1)C(=O)N[C@H]3C[C@H]4CCC[C@@H](C3)N4C.Cl SAM001246527
C[C@@H]1CN(C[C@@H](N1)C)CCCn2c3ccccc3c4c2cccc4.O.Cl SAM001247094
CCCCN1CCCC1CNC(=O)c2cc(c3ccccc3c2OC)C#N SAM001247092
C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@H]1C(=O)CO)C)O)F)C SAM001246885
CN(C)CC[C@@H](c1ccc(cc1)Cl)c2ccccn2.C(=C\C(=O)O)\C(=O)O SAM001246557
CCC(C)(C)NC(=NC#N)Nc1cccnc1 SAM001247088
CS(=O)(=O)Nc1ccc(cc1)Cc2nc(on2)c3ccc4c(c3)c(c[nH]4)CCN.O SAM001247090
Cc1c(n(nc1C(=O)NN2CCCCC2)c3ccc(cc3Cl)Cl)c4ccc(cc4)I SAM001247081
CC(CCCCC(=O)Nc1ccc(cc1)C(F)(F)F)NCCc2c[nH]cn2.C(=C\C(=O)O)\C(=O)O SAM001247089
c1ccc2c(c1)CN[C@H]3[C@H]2c4cc(c(cc4CC3)O)O.O.Cl SAM001247083
Cc1cccc(n1)CCN2CCC(CC2)C(=O)c3ccc(cc3)NS(=O)(=O)C.Cl SAM001247091
c1ccc(cc1)N2c3ccccc3C(C2=O)(Cc4ccncc4)Cc5ccncc5.O.Cl SAM001247076
CC1CC2C3CCC4=CC(=O)C=CC4([C@]3(C(CC2(C1(C(=O)CO)O)C)O)Cl)C SAM001246898
Cc1cnc(c(c1OC)C)CS(=O)c2[nH]c3ccc(cc3n2)OC SAM001246900
CS(=O)(=O)O.c1ccc2c(c1)c(c[nH]2)C(=O)O[C@H]3C[C@H]4C[C@H]5C[C@@H](C3)N4CC5=O SAM001246842
CN(C)CCc1c[nH]c2c1cc(cc2)C[C@H]3COC(=O)N3 SAM001246841
c1ccc(cc1)C(=O)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2Oc3ccccc3COC(=O)C4(C=CCCC4=O)O)CO)O)O SAM001246852
Cc1ccc(c2c1oc-3c(c(=O)c(c(c3n2)C(=O)N[C@H]4[C@H](OC(=O)[C@@H](N(C(=O)CN(C(=O)[C@@H]5CCCN5C(=O)[C@H](NC4=O)C(C)C)C)C)C(C)C)C)N)C)C(=O)N[C@H]6[C@H](OC(=O)[C@@H](N(C(=O)CN(C(=O)[C@@H]7CCCN7C(=O)[C@H](NC6=O)C(C)C)C)C)C(C)C)C SAM001246846
CN(C)C[C@H]1CCCC[C@@]1(c2cccc(c2)OC)O.Cl SAM001246847
CNC1=Nc2ccc(cc2C(=[N+](C1)[O-])c3ccccc3)Cl SAM001246815
C=CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)C(=NOCC(=O)O)c3csc(n3)N)SC1)C(=O)O.O SAM001246816
C=CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)C(=NO)c3csc(n3)N)SC1)C(=O)O SAM001246818
CC(C1=NCCN1)Oc2c(cccc2Cl)Cl.Cl SAM001246820
c1cc(ccc1C(=O)NCCC(=O)O)N=Nc2ccc(c(c2)C(=O)O)O SAM001246804
CN(C)CC/C=C\1/c2ccccc2COc3c1cc(cc3)CC(=O)O.Cl SAM001246802
c1cc2c(c(c(nc2cc1)C3CC3)/C=C/[C@@H](O)C[C@@H](O)CC(=O)O[Ca]OC(=O)C[C@H](O)C[C@H](O)/C=C/c4c(nc5c(c4c6ccc(cc6)F)cccc5)C7CC7)c8ccc(cc8)F SAM001246803
C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C SAM001246882
CN1CCC(=C2c3ccccc3C=Cc4c2cccc4)CC1.Cl SAM001246883
C[C@]12c3cc4c(cc3CCN5[C@@]1(CCC5)C=C(C2OC(=O)[C@@](CCCC(C)(C)O)(CC(=O)O)O)OC)OCO4 SAM001246822
C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@H]4C(=O)CO)C)O SAM001246879
CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@@H]1N4CCCCC4)C)CC[C@]5([C@H]3C[C@@H]([C@@H]5OC(=O)C)[N+]6(CCCCC6)C)C.[Br-] SAM001246821
C[C@@H]1CC2=C(CCC(=O)C2)[C@@H]3[C@@H]1[C@@H]4CC[C@]([C@]4(CC3)C)(C#C)O SAM001246801
c1cc(cnc1)C(=O)N SAM001246860
c1ccc(cc1)CNC(=O)CCNNC(=O)c2ccncc2 SAM001246861
CC[C@@]1(C[C@@H]2C[C@@](c3c(c4ccccc4[nH]3)CCN(C2)C1)(c5cc6c(cc5OC)N([C@@H]7[C@]68CCN9[C@H]8[C@@](C=CC9)([C@H]([C@@]7(C(=O)N)O)O)CC)C)C(=O)OC)O.OS(=O)(=O)O SAM001246568
CC[C@@]1(C[C@H]2C[C@@](c3c(c4ccccc4[nH]3)CCN(C2)C1)(c5cc6c(cc5OC)N([C@@H]7[C@]68CCN9[C@H]8[C@@](C=CC9)([C@H]([C@@]7(C(=O)OC)O)OC(=O)C)CC)C=O)C(=O)OC)O.OS(=O)(=O)O SAM001246570
CCOC(=O)C1=C(N=C(/C(=C(/O)\OCC)/C1c2ccccc2/C=C/C(=O)OC(C)(C)C)C)C SAM001246648
CN1CCN2c3c(cccn3)Cc4ccccc4C2C1 SAM001246659
CCOC(=O)OC(C)OC1=C(N(S(=O)(=O)c2c1cccc2)C)C(=O)Nc3ccccn3 SAM001246707
CCC1=C(CN(C1=O)C(=O)NCCc2ccc(cc2)S(=O)(=O)NC(=O)N[C@H]3CC[C@@H](CC3)C)C SAM001246710
CCO/C(=C\1/C(C(=C(N=C1COCCN)C)C(=O)OC)c2ccccc2Cl)/O SAM001246705
Cc1c(ccnc1CS(=O)c2[nH]c3ccccc3n2)OCCCOC SAM001246619
CC(C)N=c1cc-2n(c3ccccc3nc2cc1Nc4ccc(cc4)Cl)c5ccc(cc5)Cl SAM001246878
CCc1c2cc(ccc2nc-3c1Cn4c3cc5c(c4=O)COC(=O)[C@@]5(CC)O)OC(=O)N6CCC(CC6)N7CCCCC7.O.Cl SAM001246598
Cc1c(ccnc1CS(=O)c2[nH]c3ccccc3n2)OCC(F)(F)F SAM001246544
c1cc2c(nc1)C(=C3CCNCC3)c4ccc(cc4CC2)Cl SAM001246545
C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1CCC2=O)OS(=O)(=O)[O-].[Na+] SAM001246904
CC#C[C@@]1(CC[C@@H]2[C@@]1(C[C@@H](C3=C4CCC(=O)C=C4CC[C@@H]23)c5ccc(cc5)N(C)C)C)O SAM001246881
C[C@@H]1OC[C@@H]2[C@@H](O1)[C@@H]([C@H]([C@@H](O2)O[C@@H]3c4cc5c(cc4[C@H]([C@@H]6[C@@H]3COC6=O)c7cc(c(c(c7)OC)O)OC)OCO5)O)O SAM001246880
CC(C)CC(C1(CCC1)c2ccc(cc2)Cl)N(C)C SAM001247105
c1cc(ccc1CNC(=N)SCCCc2c[nH]cn2)Cl SAM001247107
C/C=C\1/[C@@H]2Cc3c(ccc(n3)O)[C@]1(CC(=C2)C)N SAM001246851
CC(C)CC(C1(CCC1)c2ccc(cc2)Cl)N(C)C.O.Cl SAM001246592
c1ccc(c(c1)C2=NC(C(=O)Nc3c2cc(cc3)Cl)O)Cl SAM001246833
c1ccc2c(c1)OCC(O2)CNCCN3C(=O)CC4(CCCC4)CC3=O.Br SAM001247108
c1nc(c2c(n1)n(cn2)[C@H]3[C@H](C([C@H](O3)CO)O)O)N[C@H]4CCC[C@@H]4O.O.Cl SAM001247106
CCCCc1c(c2ccccc2o1)C(=O)c3cc(c(c(c3)I)OCCN(CC)CC)I.Cl SAM001246646
CC[C@H](C)C(=O)O[C@H]1CCC=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H]3C[C@H](CC(=O)O3)O SAM001246644
Cc1ccc(cc1Nc2nccc(n2)c3cccnc3)NC(=O)c4ccc(cc4)CN5CCN(CC5)C.CS(=O)(=O)O SAM001246622
CC1CCN(CC1)CCCC(=O)c2ccc(cc2)F.Cl SAM001247102
CCC(=O)[N-]S(=O)(=O)c1ccc(cc1)c2c(onc2c3ccccc3)C.[Na+] SAM001246773
CCCN1C[C@@H](C[C@H]2[C@H]1Cc3c[nH]c4c3c2ccc4)CSC.CS(=O)(=O)O SAM001247070
C[N+]1(CCc2cc(c(cc2C1Cc3ccc(c(c3)OC)OC)OC)OC)CCC(=O)OCCCCCOC(=O)CC[N+]4(CCc5cc(c(cc5C4Cc6ccc(c(c6)OC)OC)OC)OC)C.c1ccc(cc1)S(=O)(=O)[O-] SAM001246793
C[C@@H]1CC[C@H]2[C@H]([C@H](O[C@H]3[C@@]24[C@H]1CC[C@](O3)(OO4)C)OC)C SAM001246799
c1ccc(cc1)n2c(=O)c3ccccc3[se]2 SAM001247071
CN1CCN(CC1)c2c3cccn3c4ccc(cc4n2)C(F)(F)F.C(=C\C(=O)O)\C(=O)O SAM001247066
CC[C@@H]1[C@@]2([C@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H](C(=O)[C@H](C(=O)O1)C)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)OC)C)C)N(C(=O)O2)CCCCn4cc(nc4)c5cccnc5)C SAM001246805
c1nc2c(nc(nc2n1[C@H]3[C@H](C([C@H](O3)CO)O)O)Cl)NC4CCCC4.O SAM001247065
Cc1c(sc(c1C(=O)c2cccc(c2)C(F)(F)F)N)C SAM001247067
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CC[C@@H]4[C@@]3(Cc5c[nH]nc5C4)C SAM001246590
CCN(c1cccc(c1)c2ccnc3n2ncc3C#N)C(=O)C SAM001246641
CCCCC[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1CCCCCCC(=O)O)O)O SAM001246840
C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC(=O)CC[C@]34C SAM001246921
C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC=C4[C@@]3(CC[C@@H](C4)O)C SAM001246922
CC(=C)CN1CC[C@]23c4c5ccc(c4O[C@H]2c6c(c7ccccc7[nH]6)C[C@]3(C1C5)O)O.O.Cl SAM001247099
CS(=O)(=O)c1ccc(cc1)c2cc(sc2c3ccc(cc3)F)Br SAM001247101
CCCCCCCCCOc1ccc2c(c1)c(c[nH]2)CCN.Cl SAM001247103
c1ccc(cc1)CCCCOCCCCCCNCC(c2ccc(c(c2)CO)O)O SAM001247096
CN1CC[C@@]2(Cc3c(cc4ccccc4n3)C[C@H]2C1)c5cccc(c5)O.O.Br SAM001247097
CN1CCc2cc(c(cc2[C@H](C1)c3ccccc3)O)Cl.Cl SAM001247098