In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2005 | 20 | No |
Popular Name: CLOFARABINE CLOFARABINE
Find On: PubMed — Wikipedia — Google
CAS Numbers: 123318-82-1 , [123318-82-1]
(2R,3R,4S,5R)-5-(6-Amino-2-chloro-purin-9-yl)-4-fluoro-2-hydroxymethyl-tetrahydro-furan-3-ol
(2R,3R,4S,5R)-5-(6-amino-2-chloropurin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol
123318-82-1; Clofarabine (JAN/USAN/INN); Clolar (TN); D03546
2-chloro-9-(2'-deoxy-2'-fluoro-beta-D-arabinofuranosyl)adenine
2-Chloro-9-(2-deoxy-2-fluoro-b-D-arabinofuranosyl)-9H-purin-6-amine
2-Chloro-9-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-9H-purin-6-amine
2-Chloro-9-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)adenine
5-(6-amino-2-chloro-purin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol
9H-Purin-6-amine, 2-chloro-9-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.12 | -8.62 | -11.55 | 4 | 8 | 0 | 119 | 303.681 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
biological_use | . | ZereneX Building Blocks |
ALOGPS_SOLUBILITY | 4.89e+00 g/l | DrugBank-approved |
Purity | 99% | Fluorochem |
Therapy | antineoplastic | SMDC Pharmakon |
Target | DNA/RNA Synthesis | Selleck Chemicals |
mechanism | Purine nucleoside antimetabolite | ZereneX Building Blocks |
biological_use | Used in paediatrics to treat a type of leukaemia called relapsed or refractory acute lymphoblastic leukaemia (ALL), acute myeloid leukaemia (AML) and juvenile myelomonocytic leukaemia (JMML) | IBScreen Bioactives |