UCSF

ZINC31992940

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 18 No

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Annotations

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) -1.53 1.9 -9.52 2 6 0 81 250.302 2
Mid Mid (pH 6-8) -1.53 2.22 -57.07 3 6 1 83 251.31 2

Activity (Go SEA)

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