UCSF

ZINC57694444

Substance Information

In ZINC since Heavy atoms Benign functionality
January 24th, 2011 22 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) 1.15 8.13 -9.26 1 7 0 80 321.768 5
Hi High (pH 8-9.5) 1.33 8.36 -41.12 0 7 -1 86 320.76 5

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