UCSF

ZINC58272390

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2011 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) 2.26 4.58 -18.58 2 7 0 74 362.474 5
Lo Low (pH 4.5-6) 2.26 6.82 -50.5 3 7 1 75 363.482 5

Activity (Go SEA)

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