UCSF

ZINC22701416

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 30 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) 2.50 7.9 -21.02 2 11 0 151 483.275 6
Hi High (pH 8-9.5) 2.68 7.12 -50.97 1 11 -1 157 482.267 6

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

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