UCSF

ZINC33925314

Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2009 34 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) -0.02 10.04 -73.8 2 10 -1 153 473.502 7
Mid Mid (pH 6-8) -0.02 8.04 -45.23 3 10 0 150 474.51 7

Activity (Go SEA)

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