Mitoxantrone - Small Molecule (ID:10479-102)

HMS LINCS ID: 10479-102
Name: Mitoxantrone
Alternative Names: CL 232325; CL-232325; DHAQ; Novantron; Novantrone
LINCS ID: LSM-2481
PubChem CID: 4212
ChEBI ID:
ChEMBL ID:
Molecular Mass: 444.20
InChi: InChI=1S/C22H28N4O6/c27-11-9-23-5-7-25-13-1-2-14(26-8-6-24-10-12-28)18-17(13)21(31)19-15(29)3-4-16(30)20(19)22(18)32/h1-4,23-30H,5-12H2
InChi Key: KKZJGLLVHKMTCM-UHFFFAOYSA-N
SMILES: C1=CC(=C2C(=C1NCCNCCO)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCNCCO
Relevant Citations:
Comments:
Date Publicly Available:
Most Recent Update: 2016-04-04

Target Affinity:

(see Study 20000)
Target Affinity Spectrum Value HUGO Gene Name
2
(equivalent to 100 nM ≤ Kd < 1µM)
SLC47A1, TOP2A, TOP2B
3
(equivalent to 1µM ≤ Kd < 10 µM)
ALOX15, BTK, Dyrk1a, MBNL1, WHSC1
10
(confirmed non-binding)
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Batch Information for HMSL10479-102-1:

HMS LINCS Batch ID: 10479-102-1
Provider: Sigma-Aldrich
Provider Batch ID: 050M1241
Salt: 102
Molecular Formula: C22H30Cl2N4O6
Molecular Weight: 517.4
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2015-08-24
Most Recent Update: 2016-04-04