UCSF

ZINC49756960

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2010 43 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) -1.14 -12.59 -21.89 10 16 0 269 610.521 6
Hi High (pH 8-9.5) -1.14 -11.6 -68.32 9 16 -1 272 609.513 6

Activity (Go SEA)

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