UCSF

ZINC44442891

Substance Information

In ZINC since Heavy atoms Benign functionality
May 28th, 2010 24 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) 1.50 9.82 -14.45 0 7 0 67 322.372 2
Lo Low (pH 4.5-6) 1.50 10.26 -34.8 1 7 1 68 323.38 2

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