UCSF

ZINC40440007

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2010 33 Yes

Popular Name: 8-methyl-2-morpholino-7-[2-(4-phenylpiperazin-1-yl)ethoxy]chromen-4-one 8-methyl-2-morpholino-7-[2-(4-ph…

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) 0.33 9.1 -85.85 2 7 2 63 451.567 5 ↓
Hi High (pH 8-9.5) 3.92 8.71 -12.6 0 7 0 58 449.551 6 ↓
Mid Mid (pH 6-8) 0.33 6.89 -30.6 1 7 1 61 450.559 5 ↓

Activity (Go SEA)

Rings

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

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