UCSF

ZINC07355860

Substance Information

In ZINC since Heavy atoms Benign functionality
May 26th, 2006 28 No

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Annotations

Vendors

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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) 2.49 9.44 -50.59 3 6 1 66 383.516 8
Hi High (pH 8-9.5) 2.49 6.82 -17.06 2 6 0 65 382.508 8
Lo Low (pH 4.5-6) 2.49 10.2 -72.03 4 6 0 67 384.524 8

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