UCSF

ZINC39917161

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 29 Yes

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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) 4.49 11.11 -44.07 1 5 1 35 413.973 7
Mid Mid (pH 6-8) 4.49 11.8 -88.75 2 5 2 36 414.981 7
Mid Mid (pH 6-8) 4.49 10.98 -40.61 1 5 1 35 413.973 7
Mid Mid (pH 6-8) 4.49 8.75 -11.09 0 5 0 34 412.965 7

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