UCSF

ZINC35017639

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 36 No

Popular Name: 2-[(2Z)-2-[[(4-fluorophenyl)methylamino]-hydroxy-methylene]-9,9-dimethyl-3,4-dioxo-6,7-dihydropyrazi 2-[(2Z)-2-[[(4-fluorophenyl)meth…

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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) 1.01 1.66 -17.51 3 10 0 133 494.527 7 ↓
Mid Mid (pH 6-8) 1.01 2.28 -58.85 2 10 -1 136 493.519 7 ↓
Lo Low (pH 4.5-6) 1.01 3.38 -47.82 4 10 1 135 495.535 7 ↓
Lo Low (pH 4.5-6) 1.01 3.83 -90.13 5 10 2 136 496.543 7 ↓

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

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