UCSF

ZINC22913751

Substance Information

In ZINC since Heavy atoms Benign functionality
December 22nd, 2008 23 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) 2.31 8.14 -43.76 1 4 1 30 314.453 9
Hi High (pH 8-9.5) 2.31 5.82 -6.11 0 4 0 29 313.445 9
Mid Mid (pH 6-8) 2.31 8.46 -43.73 1 4 1 30 314.453 9
Lo Low (pH 4.5-6) 2.31 8.9 -88.92 2 4 2 31 315.461 9

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