UCSF

ZINC38585986

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 21 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) 0.69 3.01 -11.02 3 7 0 97 284.323 4
Hi High (pH 8-9.5) 0.69 1.98 -35.5 2 7 -1 99 283.315 4
Lo Low (pH 4.5-6) 0.69 2.86 -11.04 3 7 0 100 284.323 5

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

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