UCSF

ZINC06679339

Substance Information

In ZINC since Heavy atoms Benign functionality
April 14th, 2006 22 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) 2.74 4.56 -12.47 2 5 0 82 294.31 4
Hi High (pH 8-9.5) 2.93 3.07 -43.24 1 5 -1 89 293.302 4

Activity (Go SEA)

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