UCSF

ZINC23946216

Substance Information

In ZINC since Heavy atoms Benign functionality
January 10th, 2009 22 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) 2.45 5.6 -16.43 2 6 0 79 303.362 6
Hi High (pH 8-9.5) 2.63 4.09 -55.98 1 6 -1 85 302.354 6

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

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