UCSF

ZINC59465716

Substance Information

In ZINC since Heavy atoms Benign functionality
March 5th, 2011 18 No

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Annotations

None

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) 0.32 1.59 -13.13 3 6 0 98 248.238 5
Hi High (pH 8-9.5) 0.50 -0.25 -43.84 2 6 -1 105 247.23 5

Activity (Go SEA)

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