UCSF

ZINC40389789

Substance Information

In ZINC since Heavy atoms Benign functionality
April 6th, 2010 26 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) 3.40 8.31 -11.49 0 5 0 40 351.45 7
Mid Mid (pH 6-8) 3.40 10.57 -51.36 1 5 1 41 352.458 7
Lo Low (pH 4.5-6) 3.40 11.25 -98.64 2 5 2 42 353.466 7

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