UCSF

ZINC36754438

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2009 19 Yes

Popular Name: 2-[(4-amino-1-piperidyl)methyl]quinazolin-4-amine 2-[(4-amino-1-piperidyl)methyl]q…

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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) 0.32 1.69 -47.65 5 5 1 83 258.349 2 ↓
Mid Mid (pH 6-8) 0.32 2.01 -81.96 6 5 2 84 259.357 2 ↓
Mid Mid (pH 6-8) 0.32 3.6 -32.19 5 5 1 82 258.349 2 ↓

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

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