UCSF

ZINC61379546

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2011 18 Yes

Popular Name: N-(2-methoxyethyl)-N-methyl-N'-(tetrazolo[1,5-a]pyrazin-5-yl)ethane-1,2-diamine N-(2-methoxyethyl)-N-methyl-N'-(…

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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) -0.28 2.41 -50.53 2 8 1 82 252.302 7 ↓
Mid Mid (pH 6-8) -0.28 -0.02 -9.05 1 8 0 80 251.294 7 ↓
Lo Low (pH 4.5-6) -0.28 2.87 -110.41 3 8 2 83 253.31 7 ↓

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

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