UCSF

ZINC65330094

Substance Information

In ZINC since Heavy atoms Benign functionality
July 10th, 2011 32 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) 2.54 7.06 -16.59 0 7 0 62 427.508 3
Mid Mid (pH 6-8) 2.54 9.06 -64.37 1 7 1 64 428.516 3

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

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