UCSF

ZINC56043787

Substance Information

In ZINC since Heavy atoms Benign functionality
December 25th, 2010 23 No

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Annotations

None

Vendors

    None

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) 3.62 8.26 -10.91 2 5 0 60 375.277 6
Mid Mid (pH 6-8) 2.87 7.17 -33.38 1 5 -1 66 374.269 5

Activity (Go SEA)

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