UCSF

ZINC40110453

Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2010 33 No

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Annotations

Vendors

    None

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) -0.29 1.77 -60.51 1 10 -1 140 474.515 10
Lo Low (pH 4.5-6) -0.29 1 -19.16 2 10 0 137 475.523 10

Activity (Go SEA)

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