UCSF

ZINC21738482

Substance Information

In ZINC since Heavy atoms Benign functionality
December 8th, 2008 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) 1.49 5.93 -22.81 3 10 0 134 495.33 7
Hi High (pH 8-9.5) 1.68 5.15 -54.4 2 10 -1 140 494.322 7

Activity (Go SEA)

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