UCSF

ZINC29228499

Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2009 17 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) -2.97 3.9 -33.07 1 4 1 32 240.371 5
Mid Mid (pH 6-8) -2.97 6.4 -104.01 2 4 2 34 241.379 5

Activity (Go SEA)

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