UCSF

ZINC11535754

Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2008 14 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) 0.21 0.14 -10.88 0 4 0 52 188.186 2
Lo Low (pH 4.5-6) 0.21 0.21 -31.12 1 4 1 53 189.194 2

Activity (Go SEA)

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