UCSF

ZINC05940219

Substance Information

In ZINC since Heavy atoms Benign functionality
February 19th, 2006 23 No

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Annotations

None

Vendors

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) 2.79 -2.42 -14.71 1 8 0 117 356.429 7
Hi High (pH 8-9.5) 2.79 -1.91 -51.06 0 8 -1 119 355.421 7

Activity (Go SEA)

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