UCSF

ZINC06732196

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2006 11 Yes

Popular Name: 2,3,4,5-Tetrahydro-1h-benzo[b][1,4]diazepine 2,3,4,5-Tetrahydro-1h-benzo[b][1…

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CAS Numbers: 6516-89-8 , [6516-89-8]

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) 1.74 3.15 -32.2 3 2 1 29 149.217 0 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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