UCSF

ZINC09272424

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 38 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) 5.35 14.34 -56.13 2 6 1 71 517.621 11
Mid Mid (pH 6-8) 4.77 2.42 -68.73 1 6 1 68 517.621 11

Activity (Go SEA)

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