UCSF

ZINC34615158

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 16 No

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Annotations

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) 2.41 8.67 -48.54 0 3 -1 57 284.129 6
Lo Low (pH 4.5-6) 2.41 6.69 -13.12 1 3 0 54 285.137 6

Activity (Go SEA)

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