UCSF

ZINC27565576

Substance Information

In ZINC since Heavy atoms Benign functionality
February 17th, 2009 22 No

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Annotations

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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) 2.10 6.71 -38 2 5 1 54 345.25 4
Hi High (pH 8-9.5) 1.91 5.64 -33.19 1 5 0 60 344.242 4
Hi High (pH 8-9.5) 2.10 4.55 -10.95 1 5 0 53 344.242 4

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