UCSF

ZINC39963892

Substance Information

In ZINC since Heavy atoms Benign functionality
March 19th, 2010 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) 2.34 8.44 -47.87 1 8 1 77 395.487 5
Mid Mid (pH 6-8) 2.34 6.21 -11.86 0 8 0 76 394.479 5

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