UCSF

ZINC02527953

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 15 Yes

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) 2.67 6.72 -44.68 3 3 1 54 216.345 11

Vendor Notes

Note Type Comments Provided By
MP 96 TCI

Activity (Go SEA)

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