UCSF

ZINC14984902

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 10 Yes

Popular Name: 1H-Pyrrolo[2,3-b]pyridin-3-amine 1H-Pyrrolo[2,3-b]pyridin-3-amine

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CAS Numbers: 189882-31-3 , 100960-08-5 , 189882-31-3 , [100960-08-5] , [189882-31-3]

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) 0.67 1.71 -6.81 3 3 0 55 133.154 0 ↓
Ref Reference (pH 7) 0.36 0.96 -33.39 3 3 1 53 134.162 0 ↓
Lo Low (pH 4.5-6) 0.36 1.42 -92.31 4 3 2 54 135.17 0 ↓
Lo Low (pH 4.5-6) 0.67 1.94 -29.35 4 3 1 56 134.162 0 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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