UCSF

ZINC52510853

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2010 20 Yes

Popular Name: N-ethyl-2-[4-(ethylaminomethyl)triazol-1-yl]-N-[[(2S)-tetrahydrofuran-2-yl]methyl]ethanamine N-ethyl-2-[4-(ethylaminomethyl)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) 0.81 5.61 -93.7 3 6 2 61 283.42 9 ↓
Hi High (pH 8-9.5) 0.81 4.23 -42.08 2 6 1 56 282.412 9 ↓

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

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