UCSF

ZINC21531583

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2008 18 Yes

Popular Name: 4-(4-ethylpiperazin-1-yl)-3-methyl-isoxazolo[4,5-e]pyrimidine 4-(4-ethylpiperazin-1-yl)-3-meth…

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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) 0.84 5.4 -48.73 1 6 1 59 248.31 2 ↓
Mid Mid (pH 6-8) 0.84 3.17 -8.14 0 6 0 58 247.302 2 ↓

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

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