UCSF

ZINC39917300

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 27 Yes

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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) 5.73 14.55 -37.99 1 3 1 22 360.525 5
Hi High (pH 8-9.5) 5.73 12.61 -9.26 0 3 0 21 359.517 5
Lo Low (pH 4.5-6) 5.73 15.29 -104.72 2 3 2 24 361.533 5

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