UCSF

ZINC35484997

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 33 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 5.70 13.65 -11.99 1 6 0 75 449.539 5
Hi High (pH 8-9.5) 4.78 12.55 -51.76 0 6 -1 74 448.531 6

Activity (Go SEA)

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