UCSF

ZINC07612957

Substance Information

In ZINC since Heavy atoms Benign functionality
June 7th, 2006 16 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) -3.77 -4.33 -33.31 1 5 1 41 228.316 5
Mid Mid (pH 6-8) -3.77 -0.99 -102.87 2 5 2 42 229.324 5

Activity (Go SEA)

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