UCSF

ZINC00150185

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 Yes

Popular Name: 1-(3-amino-4-piperidinophenyl)-1-ethanone 1-(3-amino-4-piperidinophenyl)-1…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 30877-81-7 , [30877-81-7]

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) 2.26 -1.81 -6.22 2 3 0 46 218.3 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 133 - 136 KeyOrganics
MP 133-136° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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