UCSF

ZINC34595506

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 31 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) 0.16 5.3 -24.35 3 12 0 163 469.501 9
Hi High (pH 8-9.5) 0.34 3.55 -61.42 2 12 -1 169 468.493 9

Activity (Go SEA)

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