UCSF

ZINC45751469

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2010 22 No

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Annotations

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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) 2.90 9.8 -37.91 1 6 1 69 307.37 6
Hi High (pH 8-9.5) 2.90 7.69 -6.32 0 6 0 68 306.362 6

Activity (Go SEA)

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