UCSF

ZINC05495270

Substance Information

In ZINC since Heavy atoms Benign functionality
February 3rd, 2006 12 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) -1.11 3.21 -46.99 1 6 -1 94 167.148 3
Mid Mid (pH 6-8) -1.29 5.56 -19.08 2 6 0 88 168.156 3

Activity (Go SEA)

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