UCSF

ZINC37815179

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 17 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) -0.65 2.03 -47.7 3 5 1 66 258.367 2
Mid Mid (pH 6-8) -0.65 0.88 -16.62 2 5 0 61 257.359 2

Activity (Go SEA)

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