UCSF

ZINC21534454

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2008 35 Yes

Popular Name: 3-(4-ethyl-3,5-dioxo-2-phenyl-1,2,4-triazin-6-yl)-N-[3-(4-ethylpiperazin-1-yl)propyl]-1,2,4-oxadiazo 3-(4-ethyl-3,5-dioxo-2-phenyl-1,…

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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) 0.32 5.31 -47.05 2 12 1 133 483.553 9 ↓
Hi High (pH 8-9.5) 0.32 3 -14.06 1 12 0 131 482.545 9 ↓
Mid Mid (pH 6-8) 0.32 5.31 -54.4 2 12 1 133 483.553 9 ↓

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

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