UCSF

ZINC21027854

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2008 24 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) 3.98 7.6 -38.97 1 7 -1 107 329.332 6
Mid Mid (pH 6-8) 3.98 6.82 -26.21 2 7 0 104 330.34 6

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