UCSF

ZINC06628494

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2006 30 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) 1.42 6.86 -18.06 1 8 0 100 410.426 6
Mid Mid (pH 6-8) 0.84 7.81 -17.22 0 8 0 97 410.426 6

Activity (Go SEA)

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