UCSF

ZINC35643677

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2009 23 No

Popular Name: 6-Dehydronandrolone acetate 6-Dehydronandrolone acetate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 2590-41-2 , [2590-41-2]

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) 3.20 10.98 -12.01 0 3 0 43 314.425 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0367576A2; EP0480950A1; EP0480950B1; EP0595796A1; EP0857487A2; EP0857487A3; EP0869132A1; EP0943328A2; US5204337; US5372996; US5395842; US5593981; US5595985; US5610150; US5631249; US5686437; US5686465; US5817649; US5840735; US5866560; US6077873; WO199100 IBM Patent Data

Activity (Go SEA)

Rings

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

No pre-computed analogs available. Try a structural similarity search.