UCSF

ZINC06548350

Substance Information

In ZINC since Heavy atoms Benign functionality
April 6th, 2006 26 No

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Annotations

Vendors

    None

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) 3.95 12.71 -14.56 1 3 0 28 385.895 7
Lo Low (pH 4.5-6) 3.95 13.18 -54.69 2 3 1 29 386.903 7

Activity (Go SEA)

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