UCSF

ZINC36865140

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2009 19 No

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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) 2.77 11.4 -11.2 1 4 0 37 276.409 5
Mid Mid (pH 6-8) 2.77 11.69 -43.39 2 4 1 38 277.417 5
Lo Low (pH 4.5-6) 3.50 11.41 -45.42 1 4 0 35 276.409 5

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

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