UCSF

ZINC22779760

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 28 No

Popular Name: N-[4-[(4R)-2-amino-3-cyano-5-oxo-4H-pyrano[5,6-c]chromen-4-yl]phenyl]acetamide N-[4-[(4R)-2-amino-3-cyano-5-oxo…

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) 1.94 6.64 -26.82 3 7 0 118 373.368 2 ↓
Lo Low (pH 4.5-6) 1.94 6.97 -73.61 4 7 1 120 374.376 2 ↓

Activity (Go SEA)

Rings

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

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