UCSF

ZINC37078985

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2009 10 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) 0.86 3.26 -37.47 2 2 1 16 161.294 3
Hi High (pH 8-9.5) 0.86 0.83 -2.64 1 2 0 15 160.286 3

Activity (Go SEA)

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