UCSF

ZINC12505666

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 12 Yes

Popular Name: (6-bromo-1H-indol-2-yl)methanol (6-bromo-1H-indol-2-yl)methanol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 923197-75-5 , [923197-75-5]

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) 2.52 2.45 -6.4 2 2 0 36 226.073 1 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 111 - 113 KeyOrganics
MP 111-113° Matrix Scientific
MP 115 - 117 Enamine Building Blocks
MP 115...117 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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

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