UCSF

ZINC67028655

Substance Information

In ZINC since Heavy atoms Benign functionality
September 4th, 2011 20 No

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Annotations

None

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) 1.95 5.25 -15.83 2 5 0 57 310.448 4
Mid Mid (pH 6-8) 1.75 4.1 -42.99 1 5 -1 64 309.44 4

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

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