UCSF

ZINC40036848

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2010 38 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) 6.37 17.85 -15.68 1 7 0 78 514.67 9
Lo Low (pH 4.5-6) 6.37 18.29 -34.78 2 7 1 79 515.678 9

Activity (Go SEA)

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