UCSF

ZINC27642959

Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2009 34 No

CAS Number: 73836-78-9

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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) 1.81 8.16 -109.91 5 8 -1 157 495.662 20
Hi High (pH 8-9.5) 1.81 7.84 -105.05 4 8 -2 156 494.654 20
Lo Low (pH 4.5-6) 1.81 7.04 -69.93 6 8 0 154 496.67 20

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