UCSF

ZINC55042027

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2010 28 Yes

Popular Name: 4-(diethylaminomethyl)-5-ethyl-N-[(4-oxo-3H-phthalazin-1-yl)methyl]furan-2-carboxamide 4-(diethylaminomethyl)-5-ethyl-N…

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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) 2.55 7.43 -45.41 3 7 1 92 383.472 8 ↓
Hi High (pH 8-9.5) 2.55 5.25 -12.09 2 7 0 91 382.464 8 ↓

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

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