HMS LINCS ID: 10187-101

Name: Ki20227

Alternative Names:

LINCS ID: LSM-1188

PubChem CID: 57345770

ChEBI ID:

ChEMBL ID:

Molecular Mass: 480.15

InChi: InChI=1S/C24H24N4O5S/c1-14(23-12-25-13-34-23)27-24(29)28-17-6-5-15(9-20(17)30-2)33-19-7-8-26-18-11-22(32-4)21(31-3)10-16(18)19/h5-14H,1-4H3,(H2,27,28,29)

InChi Key: ZATITKHAYUKSBY-UHFFFAOYSA-N

SMILES: CC(C1=CN=CS1)NC(=O)NC2=C(C=C(C=C2)OC3=C4C=C(C(=CC4=NC=C3)OC)OC)OC

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10186-102

Name: Chelerythrine

Alternative Names:

LINCS ID: LSM-1187

PubChem CID: 2703

ChEBI ID:

ChEMBL ID:

Molecular Mass: 348.12

InChi: InChI=1S/C21H18NO4/c1-22-10-16-13(6-7-17(23-2)21(16)24-3)14-5-4-12-8-18-19(26-11-25-18)9-15(12)20(14)22/h4-10H,11H2,1-3H3/q+1

InChi Key: LLEJIEBFSOEYIV-UHFFFAOYSA-N

SMILES: C[N+]1=C2C(=C3C=CC(=C(C3=C1)OC)OC)C=CC4=CC5=C(C=C42)OCO5

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10185-101

Name: CC-401

Alternative Names:

LINCS ID: LSM-1186

PubChem CID: 10430360

ChEBI ID:

ChEMBL ID:

Molecular Mass: 388.20

InChi: InChI=1S/C22H24N6O/c1-2-9-28(10-3-1)11-12-29-18-6-4-5-16(13-18)21-19-14-17(22-23-15-24-27-22)7-8-20(19)25-26-21/h4-8,13-15H,1-3,9-12H2,(H,25,26)(H,23,24,27)

InChi Key: XDJCLCLBSGGNKS-UHFFFAOYSA-N

SMILES: C1CCN(CC1)CCOC2=CC=CC(=C2)C3=NNC4=C3C=C(C=C4)C5=NC=NN5

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10184-101

Name: Rigosertib

Alternative Names: ON-01910

LINCS ID: LSM-1185

PubChem CID:

ChEBI ID:

ChEMBL ID:

Molecular Mass: 450.12

InChi: InChI=1S/C21H25NO8S/c1-27-15-10-19(29-3)16(20(11-15)30-4)7-8-31(25,26)13-14-5-6-18(28-2)17(9-14)22-12-21(23)24/h5-11,22H,12-13H2,1-4H3,(H,23,24)/p-1

InChi Key: OWBFCJROIKNMGD-UHFFFAOYSA-M

SMILES: COC1=C(C=C(C=C1)CS(=O)(=O)C=CC2=C(C=C(C=C2OC)OC)OC)NCC(=O)[O-]

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10183-101

Name: BGJ398

Alternative Names: KIN001-271; NVP-BGJ398

LINCS ID: LSM-1184

PubChem CID: 53235510

ChEBI ID:

ChEMBL ID:

Molecular Mass: 559.19

InChi: InChI=1S/C26H31Cl2N7O3/c1-5-34-10-12-35(13-11-34)18-8-6-17(7-9-18)31-21-15-22(30-16-29-21)33(2)26(36)32-25-23(27)19(37-3)14-20(38-4)24(25)28/h6-9,14-16H,5,10-13H2,1-4H3,(H,32,36)(H,29,30,31)

InChi Key: QADPYRIHXKWUSV-UHFFFAOYSA-N

SMILES: CCN1CCN(CC1)C2=CC=C(C=C2)NC3=CC(=NC=N3)N(C)C(=O)NC4=C(C(=CC(=C4Cl)OC)OC)Cl

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10182-101

Name: Linifanib

Alternative Names: ABT-869; AL-39324

LINCS ID: LSM-1183

PubChem CID: 11485656

ChEBI ID:

ChEMBL ID:

Molecular Mass: 375.15

InChi: InChI=1S/C21H18FN5O/c1-12-5-10-16(22)18(11-12)25-21(28)24-14-8-6-13(7-9-14)15-3-2-4-17-19(15)20(23)27-26-17/h2-11H,1H3,(H3,23,26,27)(H2,24,25,28)

InChi Key: MPVGZUGXCQEXTM-UHFFFAOYSA-N

SMILES: CC1=CC(=C(C=C1)F)NC(=O)NC2=CC=C(C=C2)C3=C4C(=CC=C3)NN=C4N

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10181-101

Name: GDC-0879

Alternative Names:

LINCS ID: LSM-1182

PubChem CID: 57519545

ChEBI ID:

ChEMBL ID:

Molecular Mass: 334.14

InChi: InChI=1S/C19H18N4O2/c24-10-9-23-12-17(19(21-23)13-5-7-20-8-6-13)15-1-3-16-14(11-15)2-4-18(16)22-25/h1,3,5-8,11-12,24-25H,2,4,9-10H2

InChi Key: DEZZLWQELQORIU-UHFFFAOYSA-N

SMILES: C1CC(=NO)C2=C1C=C(C=C2)C3=CN(N=C3C4=CC=NC=C4)CCO

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10180-101

Name: CHIR-99021

Alternative Names: CT99021; KIN001-157

LINCS ID: LSM-1181

PubChem CID: 9956119

ChEBI ID:

ChEMBL ID:

Molecular Mass: 464.10

InChi: InChI=1S/C22H18Cl2N8/c1-13-10-29-21(31-13)17-12-30-22(32-20(17)16-4-3-15(23)8-18(16)24)27-7-6-26-19-5-2-14(9-25)11-28-19/h2-5,8,10-12H,6-7H2,1H3,(H,26,28)(H,29,31)(H,27,30,32)

InChi Key: AQGNHMOJWBZFQQ-UHFFFAOYSA-N

SMILES: CC1=CN=C(N1)C2=CN=C(N=C2C3=C(C=C(C=C3)Cl)Cl)NCCNC4=NC=C(C=C4)C#N

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10179-101

Name: ABT-737

Alternative Names:

LINCS ID: LSM-1180

PubChem CID: 11228183

ChEBI ID:

ChEMBL ID:

Molecular Mass: 812.26

InChi: InChI=1S/C42H45ClN6O5S2/c1-46(2)23-22-35(30-55-37-9-4-3-5-10-37)44-40-21-20-38(28-41(40)49(51)52)56(53,54)45-42(50)32-14-18-36(19-15-32)48-26-24-47(25-27-48)29-33-8-6-7-11-39(33)31-12-16-34(43)17-13-31/h3-21,28,35,44H,22-27,29-30H2,1-2H3,(H,45,50)/t35-/m1/s1

InChi Key: HPLNQCPCUACXLM-PGUFJCEWSA-N

SMILES: CN(C)CC[C@H](CSC1=CC=CC=C1)NC2=C(C=C(C=C2)S(=O)(=O)NC(=O)C3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5C6=CC=C(C=C6)Cl)[N+](=O)[O-]

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04

HMS LINCS ID: 10178-101

Name: OSI-930

Alternative Names:

LINCS ID: LSM-1179

PubChem CID: 9868037

ChEBI ID:

ChEMBL ID:

Molecular Mass: 443.09

InChi: InChI=1S/C22H16F3N3O2S/c23-22(24,25)30-16-7-5-15(6-8-16)28-21(29)20-19(10-12-31-20)27-13-14-9-11-26-18-4-2-1-3-17(14)18/h1-12,27H,13H2,(H,28,29)

InChi Key: FGTCROZDHDSNIO-UHFFFAOYSA-N

SMILES: C1=CC=C2C(=C1)C(=CC=N2)CNC3=C(SC=C3)C(=O)NC4=CC=C(C=C4)OC(F)(F)F

Relevant Citations:

Date Publicly Available:

Most Recent Update: 2016-04-04