UCSF

ZINC38592611

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 22 No

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Annotations

None

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) 1.37 1.18 -49.08 0 6 -1 87 294.29 2
Lo Low (pH 4.5-6) 0.91 3.8 -10.66 1 6 0 84 295.298 2
Lo Low (pH 4.5-6) 1.37 2.3 -56.99 1 6 0 89 295.298 2

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