UCSF

ZINC09019454

Substance Information

In ZINC since Heavy atoms Benign functionality
August 5th, 2007 36 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) 2.51 0.09 -54.17 2 9 1 98 497.568 9
Mid Mid (pH 6-8) 1.92 -0.08 -61.46 1 9 1 95 497.568 9

Activity (Go SEA)

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