UCSF

ZINC22709946

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 34 No

Popular Name: (4S)-6-amino-3-(4-chlorophenyl)-4-[5-(2-methyl-4-nitro-phenyl)-2-furyl]-1,4-dihydropyrano[5,6-d]pyra (4S)-6-amino-3-(4-chlorophenyl)-…

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) 5.09 8.93 -14.08 3 9 0 147 473.876 4 ↓
Lo Low (pH 4.5-6) 5.09 9.25 -63.16 4 9 1 148 474.884 4 ↓

Activity (Go SEA)

Rings

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

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