UCSF

ZINC38573846

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 15 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) -1.18 1.19 -41.8 2 7 -1 115 224.225 3
Mid Mid (pH 6-8) -1.18 1.17 -38.36 3 7 0 117 225.233 3
Mid Mid (pH 6-8) -1.05 1.22 -40.97 2 7 -1 117 224.225 3

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

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