UCSF

ZINC39847764

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 35 No

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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) 3.90 10.46 -56.66 0 6 -1 83 467.476 6
Lo Low (pH 4.5-6) 3.90 9.71 -14.58 1 6 0 80 468.484 6

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