UCSF

ZINC39736946

Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2010 32 No

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Annotations

None

Vendors

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) 7.14 15.66 -13.89 1 5 0 75 417.468 5
Mid Mid (pH 6-8) 7.14 16.12 -38.76 2 5 1 76 418.476 5

Activity (Go SEA)

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