UCSF

ZINC37278080

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 23rd, 2009 20 Yes

Popular Name: 4-[(1S)-1-[[(1R,5R,6S)-6-bicyclo[3.2.0]hept-3-enyl]amino]ethyl]benzenesulfonamide 4-[(1S)-1-[[(1R,5R,6S)-6-bicyclo…

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) 2.26 3.76 -51.54 4 4 1 77 293.412 4 ↓
Hi High (pH 8-9.5) 2.26 2.6 -9.31 3 4 0 72 292.404 4 ↓

Activity (Go SEA)

Rings

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

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