UCSF

ZINC55688663

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2010 22 No

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Annotations

None

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) 3.46 5.12 -38.79 0 7 -1 103 386.203 5
Mid Mid (pH 6-8) 3.46 5.07 -9.82 1 7 0 101 387.211 5

Activity (Go SEA)

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