UCSF

ZINC22079827

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 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) -0.24 2.38 -58.5 3 5 1 74 249.29 5
Mid Mid (pH 6-8) -0.24 1.07 -12.75 2 5 0 70 248.282 5

Activity (Go SEA)

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