UCSF

ZINC56874644

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 10th, 2011 43 No

Popular Name: 21233-18-1; Amaroswerin; C17519 21233-18-1; Amaroswerin; C17519

Find On: PubMed — Wikipedia — Google

CAS Number: 21233-18-1

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) 1.09 -5.26 -22.93 7 14 0 222 602.545 8 ↓
Hi High (pH 8-9.5) 1.09 -4.6 -65.03 6 14 -1 225 601.537 8 ↓

Activity (Go SEA)

Rings

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

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