UCSF

ZINC17142966

Substance Information

In ZINC since Heavy atoms Benign functionality
September 15th, 2008 26 No

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Annotations

Vendors

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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) -0.67 9.78 -51.06 2 11 -1 166 355.29 6
Mid Mid (pH 6-8) -2.69 8.6 -12.21 2 11 0 160 356.298 7
Mid Mid (pH 6-8) -1.48 7.46 -24.43 3 11 0 163 356.298 6

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

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