UCSF

ZINC51370865

Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2010 22 No

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Annotations

None

Vendors

    None

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) 0.13 5.64 -44.08 2 7 1 72 310.422 8
Hi High (pH 8-9.5) 0.13 3.66 -18.66 1 7 0 70 309.414 8

Activity (Go SEA)

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