UCSF

ZINC31983125

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 25 Yes

Popular Name: 4-Amino-N-(1-methyl-2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)benzamide; BRN 0843346; Benzamide, 4-amino-N-(1-methyl-2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)-; LS-25578 4-Amino-N-(1-methyl-2-(4-(2-pyri…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 1.26 5.37 -34.96 4 6 1 76 340.451 5 ↓
Mid Mid (pH 6-8) 1.26 5.05 -11.46 3 6 0 74 339.443 5 ↓
Lo Low (pH 4.5-6) 1.26 7.73 -101.63 5 6 2 77 341.459 5 ↓
Lo Low (pH 4.5-6) 1.26 7.42 -47.48 4 6 1 76 340.451 5 ↓

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.