UCSF

ZINC66407652

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2011 23 Yes

Popular Name: (-)-thebaine (-)-thebaine

Find On: PubMed — Wikipedia — Google

CAS Number: 115-37-7

Other Names:

thebaine

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) 1.62 4.79 -9.97 0 4 0 31 311.381 2 ↓

Vendor Notes

Note Type Comments Provided By
Target Steroidogenic acute regulatory protein, mitochondrial(P49675) Herbal Ingredients Targets
Target Steroidogenic acute regulatory protein, mitochondrial(P49675)&3-keto-steroid reductase(P56937) Herbal Ingredients Targets

Activity (Go SEA)

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

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