UCSF

ZINC38596365

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 26 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) 2.91 5.51 -101.1 2 6 1 86 363.422 2
Lo Low (pH 4.5-6) 2.45 7.46 -110.75 3 6 2 83 364.43 2

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

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