UCSF

ZINC20745448

Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2008 28 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) 2.73 9.11 -16.18 1 6 0 76 405.405 3
Ref Reference (pH 7) 2.55 11.53 -15.5 1 6 0 73 405.405 3

Activity (Go SEA)

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