UCSF

ZINC28862985

Substance Information

In ZINC since Heavy atoms Benign functionality
March 8th, 2009 48 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) 0.27 0.02 -63.05 9 15 1 225 665.772 6
Mid Mid (pH 6-8) 0.27 0.29 -31.44 8 15 0 221 664.764 6

Activity (Go SEA)

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