UCSF

ZINC35640095

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2009 34 Yes

Popular Name: (3R)-8-(2-chlorobenzoyl)-N-(2-dimethylaminoethyl)-4-(furan-2-carbonyl)-1-oxa-4,8-diazaspiro[4.5]deca (3R)-8-(2-chlorobenzoyl)-N-(2-di…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 1.27 7.58 -61.14 2 9 1 97 489.98 6 ↓
Hi High (pH 8-9.5) 1.46 5.55 -41.1 1 9 0 103 488.972 6 ↓

Activity (Go SEA)

Rings

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

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