UCSF

ZINC01680945

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 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) -0.42 7.96 -30.94 1 2 1 20 222.352 3

Vendor Notes

Note Type Comments Provided By
PUBCHEM_SUBSTANCE_COMMENT pending PDSP via PubChem

Activity (Go SEA)

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