UCSF

ZINC60164577

Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2011 18 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) 5.94 9.75 -4.82 0 2 0 27 252.446 12
Lo Low (pH 4.5-6) 5.94 12.07 -41.75 1 2 1 28 253.454 12

Activity (Go SEA)

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