UCSF

ZINC12020345

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2008 31 Yes

Popular Name: (2S,4R)-1-cinnamyl-N-(1,3-dihydroisobenzofuran-5-yl)-4-(tetrazol-1-yl)pyrrolidine-2-carboxamide (2S,4R)-1-cinnamyl-N-(1,3-dihydr…

Find On: PubMed — Wikipedia — Google

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) 2.32 0.82 -66.4 2 8 1 86 417.493 6 ↓

Activity (Go SEA)

Rings

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

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