UCSF

ZINC16082809

Substance Information

In ZINC since Heavy atoms Benign functionality
August 20th, 2008 21 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) 0.58 0.8 -77.07 8 7 2 125 288.307 6
Hi High (pH 8-9.5) 0.58 1.82 -51.26 7 7 1 128 287.299 6
Lo Low (pH 4.5-6) 0.32 0.87 -42.5 7 7 1 128 287.299 4
Lo Low (pH 4.5-6) 0.32 0.77 -37 7 7 1 128 287.299 4

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