UCSF

ZINC49539563

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 29 Yes

Popular Name: 2-(2-fluorophenyl)-4-[4-(2-pyridyl)piperazin-1-yl]quinazoline 2-(2-fluorophenyl)-4-[4-(2-pyrid…

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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) 4.68 14.17 -82.13 2 5 2 48 387.462 3 ↓
Mid Mid (pH 6-8) 4.68 14.19 -68.96 2 5 2 48 387.462 3 ↓
Mid Mid (pH 6-8) 4.68 13.51 -12.69 0 5 0 45 385.446 3 ↓

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