UCSF

ZINC19875741

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 17 Yes

Popular Name: N-allyl-1-benzyl-piperidin-4-amine N-allyl-1-benzyl-piperidin-4-amine

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Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.56 7.48 -35.56 2 2 1 16 231.363 5 ↓
Mid Mid (pH 6-8) 2.56 6.39 -36.77 2 2 1 20 231.363 5 ↓
Lo Low (pH 4.5-6) 2.56 8.77 -105.92 3 2 2 21 232.371 5 ↓

Activity (Go SEA)

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