UCSF

ZINC05551445

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2006 25 No

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Annotations

None

Vendors

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) 6.86 10.97 -8.08 1 3 0 45 348.471 4
Mid Mid (pH 6-8) 6.37 10.9 -44.75 0 3 -1 44 347.463 5

Activity (Go SEA)

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