UCSF

ZINC95775940

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 24th, 2014 13 Yes

Popular Name: 4-bromo-2-piperazin-1-yl-pyrimidine 4-bromo-2-piperazin-1-yl-pyrimidine

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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) 1.20 5.22 -43.41 2 4 1 46 244.116 1 ↓
Hi High (pH 8-9.5) 1.20 3.92 -5.57 1 4 0 41 243.108 1 ↓

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

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