UCSF

ZINC15021972

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2008 10 Yes

Popular Name: 6-Methyl-1H-pyrrolo[3,2-c]pyridine 6-Methyl-1H-pyrrolo[3,2-c]pyridine

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CAS Numbers: 18358-63-9 , 183586-34-7 , [183586-34-7]

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) 1.50 3.41 -6.95 1 2 0 29 132.166 0 ↓
Lo Low (pH 4.5-6) 1.50 3.67 -27.38 2 2 1 30 133.174 0 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID WO1996032391A1 IBM Patent Data

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