UCSF

ZINC57729346

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 24th, 2011 33 No

Popular Name: 3-(tert-butylamino)-2-(4-dimethylaminophenyl)-N-(2-fluorophenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazi 3-(tert-butylamino)-2-(4-dimethy…

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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) 4.28 10.38 -8.83 3 7 0 67 452.578 4 ↓
Mid Mid (pH 6-8) 4.28 9.44 -10.65 2 7 0 65 451.57 4 ↓
Lo Low (pH 4.5-6) 4.28 11.17 -20.22 4 7 0 68 453.586 4 ↓

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

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