UCSF

ZINC54766587

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 7th, 2010 15 Yes

Popular Name: N-(pyrazin-2-ylmethyl)-2-[(2S)-tetrahydrofuran-2-yl]ethanamine N-(pyrazin-2-ylmethyl)-2-[(2S)-t…

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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) 0.31 2.68 -39.96 2 4 1 52 208.285 5 ↓
Mid Mid (pH 6-8) 0.31 1.31 -6.01 1 4 0 47 207.277 5 ↓

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

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