UCSF

ZINC36753930

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: 2-[(4-amino-1-piperidyl)methyl]-7-chloro-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) 0.99 4.18 -51.27 3 5 1 65 293.778 2 ↓
Mid Mid (pH 6-8) 0.99 4.12 -93.98 4 5 2 67 294.786 2 ↓
Lo Low (pH 4.5-6) 0.99 6.48 -117.56 4 5 2 66 294.786 2 ↓

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

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