UCSF

ZINC34478659

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 16 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) 3.09 5.71 -5.39 1 2 0 29 229.201 3
Hi High (pH 8-9.5) 3.27 4.11 -40.39 0 2 -1 35 228.193 3

Activity (Go SEA)

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