UCSF

ZINC03875357

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 26 No

Popular Name: Prednisone Prednisone

Find On: PubMed — Wikipedia — Google

CAS Numbers: 53-03-2 , N/A

Other Names:

(1S,2R,10S,11S,14R,15S)-14-hydroxy-14-(2-hydroxyacetyl)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-3,6-diene-5,17-dione

(8S,9S,10R,13S,14S,17R)-17-Hydroxy-17-(2-hydroxy-acetyl)-10,13-dimethyl-7,8,9,10,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,11-dione

(8S,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,11-dione

(8S,9S,10R,13S,14S,17R)-17-Hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,10,12,13,14,15,16,17-decahydro-3H-cyclopenta[a]phenanthrene-3,11(6H)-dione

(8xi,9xi,14xi)-17,21-dihydroxypregna-1,4-diene-3,11,20-trione

(8xi,9xi,14xi)-17,21-dihydroxypregna-1,4-diene-3,11,20-trione; 1,2-Dehydrocortisone; 1,4-Pregnadiene-17-alpha,21-diol-3,11,20-trione; 1,4-Pregnadiene-17alpha,21-diol-3,11,20-trione; 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione; AI3-52939; Adasone; Ancor

.delta. E

.delta.(sup1)-Cortisone

.delta.-Cortelan

.delta.-Cortisone

.delta.-Cortone

.delta.-E

.delta.1-Cortisone

.delta.1-Dehydrocortisone

.delta.sone

1,2-Dehydrocortisone

1,2-Dehydrocortisone; 1,4-Pregnadiene-17alpha,21-diol-3,11,20-trione; 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione; Dehydrocortisone; Prednisone

1,2-Dehydrocortisone; 1,4-Pregnadiene-17alpha,21-diol-3,11,20-trione; 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione; Prednisone

1,4-Pregnadiene-17-alpha,21-diol-3,11,20-trione

1,4-Pregnadiene-17.alpha.,21-diol-3,11,20-trione

1,4-Pregnadiene-17alpha,21-diol-3,11,20-trione

1-Cortisone

1-Dehydrocortisone

17,21-Dihydroxypregna-1,4-diene-3,11,20-trione

17alpha,21-Dihydroxy-1,4-pregnadiene-3,11,20-trione

53-03-2

53-03-2; C07370; Prednisone

53-03-2; CPD001227202; Prednisone; SAM002264641

53-03-2; Prednisone; Prestwick_405

68-59-7

682

81552_FLUKA

AC-11112

AC1L1LB2

AC1Q29EZ

ACon0_000082

ACon1_000297

Adasone

AI3-52939

Ancortone

Apo-prednisone

BAN

Betapar

Bicortone

Bio-0649

BPBio1_000323

BRD-A62525898-001-02-9

BRD-K85883481-001-04-2

BSPBio_000293

C07370

C21H26O5

Cartancyl

CCRIS 2646

CHEBI:8382

CHEMBL635

CID5865

Colisone

Cortan

Cortancyl

Cortidelt

Cotone

CPD001227202

CPD001227202; Prednisone; SAM002264641

D00473; Deltasone (TN); Meticorten (TN); Prednisone (USP); Prednisone monohydrate; Rayos (TN)

Dacorten

Dacortin

DAP001041

DB00635

Decortancyl

Decortin

Decortisyl

Dehydrocortisone

Dehydrocortisone;Prednisona [INN-Spanish];Prednisonum [INN-Latin]

Dekortin

Delcortin

Dellacort

Dellacort A

Delta Cortelan

Delta E

Delta E.

delta(sup 1)-Cortisone

delta(sup 1)-Dehydrocortisone

delta-1-Cortisone

delta-1-Dehydrocortisone

Delta-cortelan

Delta-cortisone

Delta-cortone

Delta-dome

Deltacortene

Deltacortisone

Deltacortone

Deltadehydrocortisone

Deltasone

Deltasone, Liquid Pred, Orasone, Adasone

Deltasone, Liquid Pred, Orasone, Adasone, Deltacortisone,Prednisone

Deltison

Deltisona

Deltisone

Deltra

Di-Adreson

Diadreson

Econosone

EINECS 200-160-3

Encorton

Encortone

Enkortolon

Enkorton

FDA

Fernisone

Fiasone

HMS1568O15

HMS2090J13

Hostacortin

HSDB 3168

In-Sone

Incocortyl

INN

Juvason

Kortancyl

Liquid Pred

Lisacort

LMST02030180

Lodotra

LS-1325

LS-46884; Phenylbutazone and prednisolone (250:1); Prednisolone and phenylbutazone (1:250); Sterazolidin; delta-Butazolid; delta-Butazolidin; delta-Butazolidine

Me-Korti

MEGxm0_000443

Metacortandracin

Meticorten

Meticorten (Veterinary)

Metrevet (Veterinary)

MFCD00003608

MLS001061265

MLS001304073

MLS001335907

MLS001335908

MLS002154191

MLS002207083

MolPort-001-740-041

NCGC00090766-01

NCGC00090766-02

NCGC00090766-03

NCI-C04897

NCI60_000008

Nisona

Nizon

Novoprednisone

NSC 10023

NSC-10023

NSC10023

Nurison

Orasone

Origen Prednisone

P1276

P6254_SIGMA

Panafcort

Panasol

Paracort

Parmenison

Pehacort

PRD

Precort

pred-

Predeltin

Prednicen-M

Prednicorm

Prednicort

Prednicot

Prednidib

Prednilonga

Prednison

Prednisona

Prednisona [INN-Spanish]

Prednisona [INN-Spanish];Prednisonum [INN-Latin];Dehydrocortisone

prednisona; prednisone; prednisonum

Prednisone (Adasone)

Prednisone (BAN

Prednisone (FDA

Prednisone Intensol

Prednisone [INN:BAN]

Prednisone, 98%

Prednisonum

Prednisonum [INN-Latin]

Prednitone

Prednizon

Prednovister

Pregna-1,4-diene-3,11,20-trione monohydrate, 17,21-dihydroxy-

pregna-1,4-diene-3,11,20-trione, 17,21-dihydroxy-

Pregna-1,4-diene-3,11,20-trione, 17,21-hydroxy-

Presone

Prestwick0_000077

Prestwick1_000077

Prestwick2_000077

Prestwick3_000077

Prestwick_405

Pronison

Pronisone

Rayos

Rectodelt

Retrocortine

S1622_Selleck

SAM002264641

Servisone

SK-Prednisone

SMR000718760

SMR001227202

Sone

SPBio_002214

Sterapred

Supercortil

U 6020

Ultracorten

Ultracortene

UNII-VB0R961HZT

USP)

Winpred

WLN: L E5 B666 CV OV AHTTT&J A1 E1 FV1Q FQ

Wojtab

Zenadrid

Zenadrid (veterinary)

Zenadrid [veterinary]

ZINC03875357

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 1.41 4.54 -15.88 2 5 0 92 358.434 2 ↓

Vendor Notes

Note Type Comments Provided By
Molecular_Solubility 3.446 Bitter DB
ALOGPS_SOLUBILITY 1.11e-01 g/l DrugBank-approved
MP 253 - 255 Enamine Building Blocks
MP 253...255 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 99% APIChem
mechanism ACTH antagonist IBScreen Bioactives
mechanism ACTH secretion inhibitor IBScreen Bioactives
biological_use Antiinflammatory IBScreen Bioactives
mechanism Calcium mobilizer IBScreen Bioactives
mechanism Corticosteroid IBScreen Bioactives IBScreen Bioactives
Patent Database Links EP1229034; EP1514877; EP1527772; EP1537858; EP1538164; EP1543839; EP1557173; EP1580188; EP1607103; EP1611879; EP1616569; EP1616572; EP1629835; EP1637126; EP1645281; EP1649857; EP1661557; EP1688146; EP1717247; EP1731140; EP1754472; EP1762248; EP1832605; EP ChEBI
Therapy glucocorticoid SMDC Pharmakon
Target Glucocorticoid Receptor Selleck Chemicals
mechanism Gluconeogenesis promoter IBScreen Bioactives
mechanism Glycogen deposition inhibitor IBScreen Bioactives
H phrase H361: Suspected of damaging fertility or the unborn child Acros Organics
biological_use Immunosuppressive IBScreen Bioactives IBScreen Bioactives
PUBCHEM_SUBSTANCE_COMMENT NCC_SAMPLE_SUPPLIER : LightBiologicals; NCC_SUPPLIER_STRUCTURE_ID : P-7859 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
mechanism Phosphorus mobilizer IBScreen Bioactives
R phrase R63: Possible risk of harm to the unborn child. Acros Organics
PUBCHEM_SUBSTANCE_COMMENT SAMPLE_SUPPLIER: LightBiologicals; SUPPLIER_STRUCTURE_ID: P-7859 NIH Clinical Collection via PubChem
Hazard XN: Harmful Acros Organics

Activity (Go SEA)

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