UCSF

ZINC02593455

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2004 25 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) 4.85 7.25 -41.2 0 5 -1 63 373.841 5
Mid Mid (pH 6-8) 4.85 7.68 -18.2 1 5 0 60 374.849 5

Activity (Go SEA)

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