UCSF

ZINC39916889

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 25 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) 4.69 13.64 -37.97 1 3 1 22 334.487 6
Mid Mid (pH 6-8) 4.69 11.18 -10.3 0 3 0 21 333.479 6
Mid Mid (pH 6-8) 4.69 11.89 -25.45 1 3 1 22 334.487 6
Lo Low (pH 4.5-6) 4.69 14.3 -101.13 2 3 2 24 335.495 6

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