UCSF

ZINC20571599

Substance Information

In ZINC since Heavy atoms Benign functionality
November 25th, 2008 29 Yes

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Annotations

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) 4.57 8.17 -22.6 2 6 0 88 447.969 5
Mid Mid (pH 6-8) 4.57 8.23 -47.1 1 6 -1 90 446.961 5

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