UCSF

ZINC36641814

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2009 28 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) 3.21 8.2 -81.62 5 6 2 81 399.564 5
Mid Mid (pH 6-8) 3.21 7.59 -73.74 5 6 2 77 399.564 5
Lo Low (pH 4.5-6) 3.21 8.66 -162.85 6 6 3 82 400.572 5

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