UCSF

ZINC03875334

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 29 No

Popular Name: Cortisone acetate Cortisone acetate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 50-04-4 , [50-04-4]

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) 2.14 8.57 -14.86 1 6 0 98 402.487 4 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 2.78e-02 g/l DrugBank-approved
Target Glucocorticoid Receptor Selleck Chemicals
H phrase H361: Suspected of damaging fertility or the unborn child Acros Organics
PUBCHEM_SUBSTANCE_COMMENT NCC_SAMPLE_SUPPLIER : LightBiologicals; NCC_SUPPLIER_STRUCTURE_ID : C-3646 NIH Clinical Collection via PubChem
Target Others Selleck Chemicals
P phrase P201: Obtain special instructions before use; P202: Do not handle until all safety precautions have been read and understood; P281: Use personal protective equipment as required; P308 + P313: IF exposed or concerned: Get medical advice/attention Acros Organics
R phrase R63: Possible risk of harm to the unborn child. Acros Organics
PUBCHEM_SUBSTANCE_COMMENT SAMPLE_SUPPLIER: LightBiologicals; SUPPLIER_STRUCTURE_ID: C-3646 NIH Clinical Collection via PubChem
Purity USP24 APIChem
Hazard XN: Harmful Acros Organics

Activity (Go SEA)

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