UCSF

ZINC48926472

Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2010 19 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) 1.72 7.75 -12.53 0 3 0 33 252.317 2
Lo Low (pH 4.5-6) 1.72 8.27 -33.37 1 3 1 34 253.325 2

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