UCSF

ZINC71566645

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2011 30 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) 4.22 9.01 -27.8 2 9 0 134 442.478 6
Hi High (pH 8-9.5) 4.68 7.83 -56.21 1 9 -1 137 441.47 6

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

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