UCSF

ZINC23192486

Substance Information

In ZINC since Heavy atoms Benign functionality
December 27th, 2008 23 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) 2.21 7.92 -51.81 2 5 1 54 356.899 7
Hi High (pH 8-9.5) 2.21 6.26 -15.54 1 5 0 53 355.891 7

Activity (Go SEA)

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