UCSF

ZINC16577864

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2008 23 No

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Annotations

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Vendors

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) 1.61 3.27 -17.27 2 5 0 90 316.401 1
Mid Mid (pH 6-8) 1.77 3.16 -13.05 2 5 0 90 316.401 1
Mid Mid (pH 6-8) 1.61 3.74 -15.46 2 5 0 90 316.401 1

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

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