UCSF

ZINC18272096

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2008 37 No

Download: MOL2 SDF SMILES Flexibase

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) 3.30 7.63 -100 0 10 -2 143 500.463 8
Lo Low (pH 4.5-6) 2.84 10.07 -59.81 1 10 -1 140 501.471 8

Activity (Go SEA)

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