UCSF

ZINC16914517

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2008 29 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) 4.32 10.41 -57.26 1 7 -1 104 411.459 6
Ref Reference (pH 7) 4.32 9.99 -57.18 1 7 -1 104 411.459 6

Activity (Go SEA)

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