UCSF

ZINC38748470

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2010 28 No

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Annotations

None

Vendors

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) 4.21 8.92 -14.41 3 5 0 70 424.576 5
Hi High (pH 8-9.5) 4.39 7.7 -50.71 2 5 -1 76 423.568 5

Activity (Go SEA)

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