UCSF

ZINC09010220

Substance Information

In ZINC since Heavy atoms Benign functionality
August 4th, 2007 35 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) 3.09 11.27 -60.2 1 12 -1 189 482.425 11
Mid Mid (pH 6-8) 2.51 11.94 -68.78 0 12 -1 186 482.425 11

Activity (Go SEA)

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