UCSF

ZINC07612881

Substance Information

In ZINC since Heavy atoms Benign functionality
June 7th, 2006 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) -2.62 -0.53 -38.96 0 3 1 20 249.309 3
Mid Mid (pH 6-8) -2.62 2.81 -112.08 1 3 2 21 250.317 3

Activity (Go SEA)

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