UCSF

ZINC05503940

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 3rd, 2006 14 Yes

Popular Name: 2-Methyl-4-(1-piperidinyl)aniline 2-Methyl-4-(1-piperidinyl)aniline

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CAS Numbers: 1449117-37-6 , 73164-32-6 , N/A

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) 2.81 5.52 -3.2 2 2 0 29 190.29 1 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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