UCSF

ZINC01708020

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 12 No

Popular Name: 4-Nitro-2,3-dihydro-1H-indene 4-Nitro-2,3-dihydro-1H-indene

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CAS Numbers: 34701-14-9 , [34701-14-9]

Other Names:

4-NITROINDAN

MFCD00078173

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) 2.29 1.55 -7.47 0 3 0 46 163.176 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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