UCSF

ZINC62037962

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2011 20 Yes

Popular Name: [3-[4-(pyrrolidin-1-ylmethyl)-1-piperidyl]pyrazin-2-yl]methanamine [3-[4-(pyrrolidin-1-ylmethyl)-1-…

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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) 1.09 5.65 -95.07 4 5 2 61 277.416 4 ↓
Mid Mid (pH 6-8) 1.09 5.25 -37.17 3 5 1 59 276.408 4 ↓

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

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