UCSF

ZINC22768400

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 28 No

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Annotations

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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) -2.64 9.37 -50.75 2 9 1 100 385.448 5
Mid Mid (pH 6-8) 0.95 7.03 -19.35 1 9 0 93 384.44 5

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

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