UCSF

ZINC39900093

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 31 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) 6.69 14.93 -13.96 0 4 0 36 414.549 9
Lo Low (pH 4.5-6) 6.69 15.34 -30.09 1 4 1 38 415.557 9

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