UCSF

ZINC47549464

Substance Information

In ZINC since Heavy atoms Benign functionality
September 3rd, 2010 14 No

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Annotations

Vendors

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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) -0.25 -0.43 -41.79 5 5 1 91 202.278 8
Hi High (pH 8-9.5) -0.25 -2.8 -8.8 4 5 0 89 201.27 8

Activity (Go SEA)

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