UCSF

ZINC06622428

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2006 19 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) -1.37 -1.94 -29.3 3 9 0 130 266.213 2
Hi High (pH 8-9.5) -0.91 -3.99 -64.42 2 9 -1 133 265.205 2

Activity (Go SEA)

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