UCSF

ZINC19810474

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2008 11 Yes

Popular Name: 5-Chloro-2,3-dihydro-1H-inden-1-amine 5-Chloro-2,3-dihydro-1H-inden-1-…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1197668-23-7 , 67120-39-2 , 812695-59-3 , [1197668-23-7]

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) 0.34 4.1 -48.5 3 1 1 28 168.647 0 ↓
Hi High (pH 8-9.5) 0.34 3.8 -2.82 2 1 0 26 167.639 0 ↓

Vendor Notes

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

Activity (Go SEA)

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