UCSF

ZINC49320223

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2010 18 No

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Annotations

Vendors

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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) -0.73 5.77 -17.38 0 7 0 56 271.346 3
Mid Mid (pH 6-8) -0.73 8.15 -47.77 1 7 1 57 272.354 3

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

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