UCSF

ZINC05385721

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2006 25 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) -1.87 3.69 -63.7 1 11 -1 136 366.25 1
Mid Mid (pH 6-8) -1.87 4.16 -69.92 2 11 0 137 367.258 1

Activity (Go SEA)

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