UCSF

ZINC38717978

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2010 23 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) -1.45 -3.3 -8.41 2 8 0 83 328.413 8
Mid Mid (pH 6-8) -1.45 -1.03 -44.41 3 8 1 84 329.421 8
Lo Low (pH 4.5-6) -1.45 1.24 -90.61 4 8 2 86 330.429 8

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