UCSF

ZINC59090127

Substance Information

In ZINC since Heavy atoms Benign functionality
February 24th, 2011 17 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) 4.73 9.86 -105.68 3 2 2 21 244.467 10
Hi High (pH 8-9.5) 4.73 8.8 -27.99 2 2 1 16 243.459 10
Mid Mid (pH 6-8) 4.73 7.76 -31.9 2 2 1 20 243.459 10

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