UCSF

ZINC15931947

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2008 30 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) 6.99 11.67 -55.71 1 6 -1 98 458.302 4
Ref Reference (pH 7) 6.99 12.08 -56.82 1 6 -1 98 458.302 4

Activity (Go SEA)

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