UCSF

ZINC69951197

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 22 Yes

Popular Name: 4-methyl-2-(4-pyrido[2,3-b]pyrazin-6-ylpiperazin-1-yl)thiazole 4-methyl-2-(4-pyrido[2,3-b]pyraz…

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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) 2.14 6.79 -13.71 0 6 0 58 312.402 2 ↓
Mid Mid (pH 6-8) 2.14 7.19 -36.9 1 6 1 59 313.41 2 ↓
Lo Low (pH 4.5-6) 2.14 7.51 -78.84 2 6 2 61 314.418 2 ↓

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

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