UCSF

ZINC17108054

Substance Information

In ZINC since Heavy atoms Benign functionality
September 15th, 2008 20 No

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Annotations

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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) 2.58 7.21 -15.75 2 5 0 70 291.376 3
Lo Low (pH 4.5-6) 2.58 7.52 -34.79 3 5 1 71 292.384 3

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

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