UCSF

ZINC55117415

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2010 28 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) 3.47 8.83 -11.91 2 6 0 74 396.516 6
Lo Low (pH 4.5-6) 3.47 9.61 -83.41 3 6 0 75 397.524 6

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

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