UCSF

ZINC34378154

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2009 28 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) -2.33 9.36 -78.12 4 8 2 98 382.468 4
Hi High (pH 8-9.5) -2.33 7.14 -27.77 3 8 1 97 381.46 4

Activity (Go SEA)

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