UCSF

ZINC34558554

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2009 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) 1.07 2.7 -15.78 6 6 0 102 240.27 2
Lo Low (pH 4.5-6) 1.07 3.13 -26.54 7 6 1 103 241.278 2

Activity (Go SEA)

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