UCSF

ZINC71489246

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2011 33 No

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Annotations

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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) 4.08 12.75 -13.3 1 10 0 139 445.435 7
Lo Low (pH 4.5-6) 4.08 14.08 -40.74 2 10 1 140 446.443 7

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

No pre-computed analogs available. Try a structural similarity search.