UCSF

ZINC07230183

Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2006 22 Yes

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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) 2.56 3.38 -41.59 1 7 -1 99 314.35 4
Hi High (pH 8-9.5) 2.56 3.51 -99.91 0 7 -2 101 313.342 4
Lo Low (pH 4.5-6) 2.56 3.47 -14.23 2 7 0 101 315.358 4

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