UCSF

ZINC60941826

Substance Information

In ZINC since Heavy atoms Benign functionality
April 3rd, 2011 16 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) -0.02 3.84 -46.19 2 5 1 54 230.332 6
Mid Mid (pH 6-8) -0.02 1.66 -16.99 1 5 0 53 229.324 6

Activity (Go SEA)

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