UCSF

ZINC00000954

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2005 19 Yes

Popular Name: ANISOMYCIN ANISOMYCIN

Find On: PubMed — Wikipedia — Google

CAS Number: 22862-76-6

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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) 1.22 3.11 -48.22 3 5 1 72 266.317 5 ↓
Hi High (pH 8-9.5) 1.22 1.73 -11.13 2 5 0 68 265.309 5 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 2.07e+00 g/l DrugBank-experimental
Purity >95% Fluorochem
Therapy antiprotozoal, antifungal, protein synthesis inhibitor SMDC MicroSource
UniProt Database Links CCNL1_RAT; KS6A4_HUMAN; KS6A4_MOUSE; KS6A5_CHICK; KS6A5_HUMAN; KS6A5_MOUSE; KS6A5_PONAB; MAPK5_HUMAN; MAPK5_MOUSE; MK13_BOVIN; MK13_HUMAN; MK13_MOUSE; MK13_PANTR; MK13_RAT; MK14_CANFA; MK14_HUMAN; MK14_MOUSE; MK14_PANTR; MK14_RAT; MP2K6_HUMAN ChEBI

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50425-3-O Plasmodium Falciparum (cluster #3 Of 22), Other Other 4600 0.39 Functional ≤ 10μM
Z80936-1-O HEK293 (Embryonic Kidney Fibroblasts) (cluster #1 Of 4), Other Other 20 0.57 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z80936 Z80936 HEK293 (Embryonic Kidney Fibroblasts) 20 0.57 Functional ≤ 10μM
Z50425 Z50425 Plasmodium Falciparum 25 0.56 Functional ≤ 10μM

Analogs ( Draw Identity 99% 90% 80% 70% )