UCSF

ZINC12494930

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 27 No

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Annotations

Vendors

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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) -5.01 -1.65 -100.16 7 11 1 187 399.453 7
Lo Low (pH 4.5-6) -5.01 -1.4 -142.21 8 11 2 188 400.461 7
Lo Low (pH 4.5-6) -5.01 -5.8 -137.18 8 11 2 188 400.461 7

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