UCSF

ZINC35697827

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2009 21 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) 2.59 9.19 -35.89 2 4 1 42 326.511 4
Hi High (pH 8-9.5) 3.04 8.15 -43.89 1 4 0 45 325.503 4

Activity (Go SEA)

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