UCSF

ZINC32096219

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2009 25 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) 3.81 1.15 -14.43 3 6 0 91 343.427 3
Ref Reference (pH 7) 3.62 3.8 -16.02 3 6 0 87 343.427 3

Activity (Go SEA)

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