HMS LINCS ID: 10088-101

Name: XMD13-2

Alternative Names:

LINCS ID: LSM-6296

PubChem CID:

ChEBI ID:

ChEMBL ID:

Molecular Mass: 360.16

InChi: InChI=1S/C21H20N4O2/c26-20(12-4-5-12)23-19-17-9-6-14(11-18(17)24-25-19)13-2-1-3-15(10-13)21(27)22-16-7-8-16/h1-3,6,9-12,16H,4-5,7-8H2,(H,22,27)(H2,23,24,25,26)

InChi Key: WBLZCNIEEVRRTG-UHFFFAOYSA-N

SMILES: O=C(C1CC1)NC2=NNC3=CC(C4=CC(C(NC5CC5)=O)=CC=C4)=CC=C32

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10087-101

Name: XMD11-85h

Alternative Names:

LINCS ID: LSM-5577

PubChem CID:

ChEBI ID:

ChEMBL ID:

Molecular Mass: 535.33

InChi: InChI=1S/C29H41N7O3/c1-19(2)36-24-18-30-29(33-27(24)35(16-13-26(36)37)22-7-5-6-8-22)32-23-10-9-20(17-25(23)39-4)28(38)31-21-11-14-34(3)15-12-21/h9-10,17-19,21-22H,5-8,11-16H2,1-4H3,(H,31,38)(H,30,32,33)

InChi Key: VIJIVCXRKDRGGA-UHFFFAOYSA-N

SMILES: O=C1CCN(C2CCCC2)C3=NC(NC4=CC=C(C(NC5CCN(C)CC5)=O)C=C4OC)=NC=C3N1C(C)C

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10086-101

Name: XMD11-50

Alternative Names: LRRK2-in-1

LINCS ID: LSM-1086

PubChem CID: 46843906

ChEBI ID:

ChEMBL ID:

Molecular Mass: 570.31

InChi: InChI=1S/C31H38N8O3/c1-35-15-17-38(18-16-35)22-11-13-39(14-12-22)29(40)21-9-10-24(27(19-21)42-4)33-31-32-20-26-28(34-31)36(2)25-8-6-5-7-23(25)30(41)37(26)3/h5-10,19-20,22H,11-18H2,1-4H3,(H,32,33,34)

InChi Key: IWMCPJZTADUIFX-UHFFFAOYSA-N

SMILES: CN1CCN(CC1)C2CCN(CC2)C(=O)C3=CC(=C(C=C3)NC4=NC=C5C(=N4)N(C6=CC=CC=C6C(=O)N5C)C)OC

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10085-101

Name: WZ4002

Alternative Names:

LINCS ID: LSM-1085

PubChem CID: 44607530

ChEBI ID:

ChEMBL ID:

Molecular Mass: 494.18

InChi: InChI=1S/C25H27ClN6O3/c1-4-23(33)28-17-6-5-7-19(14-17)35-24-20(26)16-27-25(30-24)29-21-9-8-18(15-22(21)34-3)32-12-10-31(2)11-13-32/h4-9,14-16H,1,10-13H2,2-3H3,(H,28,33)(H,27,29,30)

InChi Key: ITTRLTNMFYIYPA-UHFFFAOYSA-N

SMILES: CN1CCN(CC1)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)OC4=CC=CC(=C4)NC(=O)C=C)Cl)OC

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10084-101

Name: WZ3105

Alternative Names:

LINCS ID: LSM-5970

PubChem CID: 42628507

ChEBI ID:

ChEMBL ID:

Molecular Mass: 462.29

InChi: InChI=1S/C25H34N8O/c1-6-21(34)27-18-8-7-9-19(14-18)28-23-22-24(33(15-26-22)16(2)3)31-25(30-23)29-17-10-12-20(13-11-17)32(4)5/h6-9,14-17,20H,1,10-13H2,2-5H3,(H,27,34)(H2,28,29,30,31)

InChi Key: DGEBYERMQBTMHV-UHFFFAOYSA-N

SMILES: CC(C)N1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)NC(=O)C=C)NC4CCC(CC4)N(C)C

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10083-101

Name: WZ-7043

Alternative Names:

LINCS ID: LSM-5749

PubChem CID:

ChEBI ID:

ChEMBL ID:

Molecular Mass: 510.19

InChi: InChI=1S/C23H32Cl2N6O3/c1-6-30(7-2)11-9-8-10-26-22-27-13-15-14-31(23(32)29(3)21(15)28-22)20-18(24)16(33-4)12-17(34-5)19(20)25/h12-13H,6-11,14H2,1-5H3,(H,26,27,28)

InChi Key: NHOUHWHGHAFDOP-UHFFFAOYSA-N

SMILES: CCN(CC)CCCCNC1=NC=C2CN(C(=O)N(C2=N1)C)C3=C(C(=CC(=C3Cl)OC)OC)Cl

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10082-101

Name: WZ-4-145

Alternative Names:

LINCS ID: LSM-5545

PubChem CID:

ChEBI ID:

ChEMBL ID:

Molecular Mass: 690.22

InChi: InChI=1S/C34H36Cl2N8O4/c1-5-30(45)40-24-8-6-22(7-9-24)20-44(34(46)41-33-31(35)26(47-3)18-27(48-4)32(33)36)29-19-28(37-21-38-29)39-23-10-12-25(13-11-23)43-16-14-42(2)15-17-43/h5-13,18-19,21H,1,14-17,20H2,2-4H3,(H,40,45)(H,41,46)(H,37,38,39)

InChi Key: SFLKJNSBBVSPFE-UHFFFAOYSA-N

SMILES: O=C(NC1=C(Cl)C(OC)=CC(OC)=C1Cl)N(CC2=CC=C(NC(C=C)=O)C=C2)C3=CC(NC4=CC=C(N5CCN(C)CC5)C=C4)=NC=N3

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10081-101

Name: KIN001-244

Alternative Names:

LINCS ID: LSM-1081

PubChem CID: 49766501

ChEBI ID:

ChEMBL ID:

Molecular Mass: 516.16

InChi: InChI=1S/C28H22F2N4O4/c29-21-10-8-17(13-22(21)30)15-34-12-4-7-20(27(34)36)26(35)31-25(18-5-2-1-3-6-18)16-38-19-9-11-23-24(14-19)33-28(37)32-23/h1-14,25H,15-16H2,(H,31,35)(H2,32,33,37)/t25-/m0/s1

InChi Key: GCWCGSPBENFEPE-VWLOTQADSA-N

SMILES: C1=CC=C(C=C1)[C@H](COC2=CC3=C(C=C2)NC(=O)N3)NC(=O)C4=CC=CN(C4=O)CC5=CC(=C(C=C5)F)F

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10080-101

Name: Torin2

Alternative Names:

LINCS ID: LSM-1080

PubChem CID: 51358113

ChEBI ID:

ChEMBL ID:

Molecular Mass: 432.12

InChi: InChI=1S/C24H15F3N4O/c25-24(26,27)17-2-1-3-18(11-17)31-22(32)9-6-16-13-29-20-7-4-14(10-19(20)23(16)31)15-5-8-21(28)30-12-15/h1-13H,(H2,28,30)

InChi Key: GUXXEUUYCAYESJ-UHFFFAOYSA-N

SMILES: C1=CC(=CC(=C1)N2C(=O)C=CC3=CN=C4C=CC(=CC4=C32)C5=CN=C(C=C5)N)C(F)(F)F

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10079-101

Name: Torin1

Alternative Names:

LINCS ID: LSM-1079

PubChem CID: 49836027

ChEBI ID:

ChEMBL ID:

Molecular Mass: 607.22

InChi: InChI=1S/C35H28F3N5O2/c1-2-32(44)42-15-13-41(14-16-42)31-11-9-26(19-28(31)35(36,37)38)43-33(45)12-8-24-20-40-30-10-7-22(18-27(30)34(24)43)25-17-23-5-3-4-6-29(23)39-21-25/h3-12,17-21H,2,13-16H2,1H3

InChi Key: AKCRNFFTGXBONI-UHFFFAOYSA-N

SMILES: CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)N3C(=O)C=CC4=CN=C5C=CC(=CC5=C43)C6=CC7=CC=CC=C7N=C6)C(F)(F)F

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04