UCSF

ZINC67225876

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2011 35 Yes

Popular Name: 2-(4-ethylpiperazin-1-yl)-6-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]thiazolo[4,5-d]pyrimi 2-(4-ethylpiperazin-1-yl)-6-[2-[…

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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) 1.72 12.24 -60.59 1 10 1 88 498.633 6 ↓
Mid Mid (pH 6-8) 1.72 10.03 -23.57 0 10 0 87 497.625 6 ↓

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Rings

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

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