UCSF

ZINC00039693

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 11 Yes

Popular Name: N-Methyl-1H-benzo[d]imidazol-2-amine N-Methyl-1H-benzo[d]imidazol-2-a…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 17228-38-5 , 5993-91-9 , [17228-38-5]

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) 1.61 4.54 -8.65 2 3 0 41 147.181 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 190 - 192 Enamine Building Blocks
MP 190...192 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
PUBCHEM_PATENT_ID US5457096 IBM Patent Data

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

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