UCSF

ZINC19798362

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2008 14 Yes

Popular Name: 8-Bromo-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole 8-Bromo-2,3,4,5-tetrahydro-1H-py…

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CAS Numbers: 497261-38-8 , [497261-38-8]

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) 2.71 3.72 -6.08 2 2 0 28 251.127 0 ↓

Vendor Notes

Note Type Comments Provided By
MP 216 - 218 Enamine Building Blocks
MP 216...218 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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