UCSF

ZINC48381243

Substance Information

In ZINC since Heavy atoms Benign functionality
September 15th, 2010 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) -0.16 7.57 -24.83 1 8 0 96 267.289 3
Lo Low (pH 4.5-6) -0.16 8.04 -52.95 2 8 1 97 268.297 3

Activity (Go SEA)

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