UCSF

ZINC62926504

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: (3S)-3-methyl-1-(tetrazolo[1,5-a]pyrazin-5-yl)pyrrolidine-3-carboxylic (3S)-3-methyl-1-(tetrazolo[1,5-a…

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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) -0.06 4.95 -64.6 1 8 0 101 248.246 2 ↓
Mid Mid (pH 6-8) -0.06 4.46 -41.74 0 8 -1 99 247.238 2 ↓
Lo Low (pH 4.5-6) -0.06 5.41 -134.24 2 8 1 102 249.254 2 ↓

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

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