UCSF

ZINC41587248

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 34 No

Popular Name: (7Z)-9-methyl-7-[(3-nitrophenyl)methylene]-3-(3-phenylpropyl)-2,4-dihydrofuro[3,2-g][1,3]benzoxazin- (7Z)-9-methyl-7-[(3-nitrophenyl)…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 5.48 12.62 -11.57 0 7 0 89 456.498 6 ↓
Mid Mid (pH 6-8) 5.48 15.49 -56.79 1 7 1 90 457.506 6 ↓

Activity (Go SEA)

Rings

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

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