UCSF

ZINC69944072

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 16 Yes

Popular Name: 3-[(2R)-2-amino-2-pyrazin-2-yl-ethyl]pyridin-2-amine 3-[(2R)-2-amino-2-pyrazin-2-yl-e…

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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) -1.70 0.53 -34.51 5 5 1 92 216.268 3 ↓
Mid Mid (pH 6-8) -1.70 0.06 -7.01 4 5 0 91 215.26 3 ↓
Mid Mid (pH 6-8) -1.70 0.86 -101.57 6 5 2 94 217.276 3 ↓
Mid Mid (pH 6-8) -1.70 0.39 -44.76 5 5 1 92 216.268 3 ↓

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Rings

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

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