UCSF

ZINC19994585

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 31 No

Popular Name: (3E)-N-(3-morpholinopropyl)-3-[[2-(1-naphthyloxy)acetyl]hydrazono]butanamide (3E)-N-(3-morpholinopropyl)-3-[[…

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) 2.28 5.99 -24.65 3 8 0 92 426.517 10 ↓
Ref Reference (pH 7) 2.28 5.71 -18.48 3 8 0 92 426.517 10 ↓
Mid Mid (pH 6-8) 2.28 7.98 -54.77 4 8 1 93 427.525 10 ↓
Mid Mid (pH 6-8) 2.28 8.27 -117.09 4 8 0 93 427.525 10 ↓

Activity (Go SEA)

Rings

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

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