UCSF

ZINC04707541

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 31st, 2005 12 No

Popular Name: 2-(Chloromethyl)-1-methyl-1H-benzo[d]imidazole 2-(Chloromethyl)-1-methyl-1H-ben…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 19412-48-7 , 4760-35-4 , [4760-35-4]

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) 2.18 0.35 -9.18 0 2 0 18 180.638 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 235 - 237 Enamine Building Blocks
MP 235...237 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks
melting_point 93 - 95 KeyOrganics
purity 95 Enamine Building Blocks
Purity 95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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