UCSF

ZINC40123494

Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2010 29 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) 1.36 2.58 -66.68 3 8 -1 131 395.391 7
Lo Low (pH 4.5-6) 1.36 1.82 -24.42 4 8 0 128 396.399 7

Activity (Go SEA)

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