UCSF

ZINC33925308

Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2009 35 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) -0.53 10.64 -73.85 2 10 -1 153 481.481 8
Mid Mid (pH 6-8) -0.53 8.65 -45.23 3 10 0 150 482.489 8

Activity (Go SEA)

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