UCSF

ZINC41652240

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 31 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) 5.26 11.14 -10 0 4 0 43 415.464 4
Lo Low (pH 4.5-6) 5.26 13.99 -56.84 1 4 1 44 416.472 4

Activity (Go SEA)

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