UCSF

ZINC41647154

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 32 No

Popular Name: (2Z)-2-[(2-bromophenyl)methylene]-4-methyl-8-(3-phenylpropyl)-7,9-dihydrofuro[2,3-f][1,3]benzoxazin- (2Z)-2-[(2-bromophenyl)methylene…

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) 6.31 12.35 -9.21 0 4 0 43 490.397 5 ↓
Lo Low (pH 4.5-6) 6.31 15.2 -54.53 1 4 1 44 491.405 5 ↓

Activity (Go SEA)

Rings

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

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