UCSF

ZINC49601295

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 23 Yes

Popular Name: 4-(4-methylpiperazin-1-yl)-2-phenyl-quinazoline 4-(4-methylpiperazin-1-yl)-2-phe…

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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) 3.77 11.87 -92.78 2 4 2 35 306.413 2 ↓
Mid Mid (pH 6-8) 3.77 9.19 -8.9 0 4 0 32 304.397 2 ↓
Lo Low (pH 4.5-6) 3.77 11.88 -79.08 2 4 2 35 306.413 2 ↓

Activity (Go SEA)

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