UCSF

ZINC19876246

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 17 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) -0.50 1.89 -13.45 2 5 0 67 232.239 2
Mid Mid (pH 6-8) -0.49 2.02 -11.44 2 5 0 67 232.239 2
Lo Low (pH 4.5-6) -0.50 2.85 -41.11 3 5 1 72 233.247 2

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