UCSF

ZINC39917613

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 32 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) 4.93 12.63 -11.94 0 5 0 40 433.596 12
Mid Mid (pH 6-8) 4.93 14.89 -48.91 1 5 1 41 434.604 12
Mid Mid (pH 6-8) 4.93 12.92 -33.91 1 5 1 41 434.604 12
Lo Low (pH 4.5-6) 4.93 15.19 -102.98 2 5 2 42 435.612 12

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