UCSF

ZINC11840879

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2008 26 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) 2.50 8.4 -11.21 0 5 0 50 366.408 5
Lo Low (pH 4.5-6) 2.50 9.73 -46.18 1 5 1 51 367.416 5

Activity (Go SEA)

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