UCSF

ZINC55104809

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2010 26 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) 4.93 12.24 -15.14 1 4 0 45 367.88 4
Hi High (pH 8-9.5) 5.12 10.49 -48.91 0 4 -1 51 366.872 4

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

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