UCSF

ZINC38592093

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 19 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) 4.05 8.33 -51.03 0 2 -1 26 309.505 1
Lo Low (pH 4.5-6) 3.32 8.68 -14.88 1 2 0 29 310.513 1

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

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