UCSF

ZINC34817612

Substance Information

In ZINC since Heavy atoms Benign functionality
September 28th, 2009 19 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) -0.64 3.69 -78.34 4 6 0 106 270.329 5
Hi High (pH 8-9.5) -0.64 3.15 -53.86 3 6 -1 104 269.321 5

Activity (Go SEA)

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