UCSF

ZINC33832898

Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 27 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) 0.79 -3.4 -15.46 5 8 0 137 378.377 4
Mid Mid (pH 6-8) 0.79 -2.4 -51.76 4 8 -1 140 377.369 4

Activity (Go SEA)

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