UCSF

ZINC71489264

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2011 31 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) 4.24 12.41 -16.85 1 7 0 93 414.465 7
Lo Low (pH 4.5-6) 4.24 13.71 -37.22 2 7 1 94 415.473 7

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

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