UCSF

ZINC01059127

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 20 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) 4.32 7.35 -9.39 1 4 0 58 284.34 2
Mid Mid (pH 6-8) 3.83 6.85 -45.65 0 4 -1 57 283.332 3

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