UCSF

ZINC36754206

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2009 20 Yes

Popular Name: 2-[(4-amino-1-piperidyl)methyl]-7-bromo-pyrido[1,2-a]pyrimidin-4-one 2-[(4-amino-1-piperidyl)methyl]-…

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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) 1.12 4.29 -50.82 3 5 1 65 338.229 2 ↓
Mid Mid (pH 6-8) 1.12 4.22 -93.7 4 5 2 67 339.237 2 ↓
Lo Low (pH 4.5-6) 1.12 6.58 -117.25 4 5 2 66 339.237 2 ↓

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