UCSF

ZINC26248124

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 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) -1.83 -1.05 -62.53 8 13 1 198 435.465 8
Mid Mid (pH 6-8) -1.83 -0.75 -92.35 9 13 2 199 436.473 8

Activity (Go SEA)

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