UCSF

ZINC38343399

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 15th, 2010 17 Yes

Popular Name: 10-benzyl-3,10-diazabicyclo[4.3.1]decane 10-benzyl-3,10-diazabicyclo[4.3.…

Find On: PubMed — Wikipedia — Google

CAS Number: 653600-91-0

Other Names:

MFCD12755905

MFCD13196458

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) 2.19 8.01 -107.85 3 2 2 21 232.371 2 ↓
Hi High (pH 8-9.5) 2.19 6.58 -38.34 2 2 1 20 231.363 2 ↓
Hi High (pH 8-9.5) 2.19 7.31 -28.47 2 2 1 16 231.363 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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