UCSF

ZINC19362182

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2008 17 Yes

Popular Name: 1-(1-naphthylmethyl)piperazine 1-(1-naphthylmethyl)piperazine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1071547-50-6 , 40675-81-8 , 40675-82-9 , [1071547-50-6] , [40675-81-8]

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) 2.20 6.01 -41.97 2 2 1 20 227.331 2 ↓
Hi High (pH 8-9.5) 2.20 4.61 -4 1 2 0 15 226.323 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 227-228° Matrix Scientific
MP 63 - 65 Enamine Building Blocks
MP 63-65° Oakwood Chemical
MP 63...65 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific

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