UCSF

ZINC15938078

Substance Information

In ZINC since Heavy atoms Benign functionality
August 4th, 2008 16 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) 0.20 3.12 -52.66 1 10 -1 136 222.144 4
Hi High (pH 8-9.5) 0.20 3.31 -19.09 2 10 0 138 223.152 4

Activity (Go SEA)

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