UCSF

ZINC31516747

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2009 34 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) 5.79 13.28 -20.56 1 4 0 64 462.63 2
Hi High (pH 8-9.5) 5.79 14.09 -68.23 0 4 -1 66 461.622 2

Activity (Go SEA)

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