UCSF

ZINC38138370

Substance Information

In ZINC since Heavy atoms Benign functionality
December 30th, 2009 37 No

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Annotations

Vendors

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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) -1.16 3.27 -76.35 4 14 -1 207 541.551 6
Hi High (pH 8-9.5) -1.16 4.29 -125.62 3 14 -2 210 540.543 6

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

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