UCSF

ZINC38596865

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 33 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) 1.00 1.39 -38.46 3 11 -1 160 458.495 5
Lo Low (pH 4.5-6) 1.00 1.85 -50.55 4 11 0 162 459.503 5

Activity (Go SEA)

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