UCSF

ZINC14401192

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 9th, 2008 11 Yes

Popular Name: 1H-Pyrrolo[3,2-b]pyridine-5-carbonitrile 1H-Pyrrolo[3,2-b]pyridine-5-carb…

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CAS Numbers: 146767-63-7 , [146767-63-7]

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 3.02 -11.26 1 3 0 52 143.149 0 ↓
Lo Low (pH 4.5-6) 1.09 3.27 -32.33 2 3 1 54 144.157 0 ↓

Vendor Notes

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

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