UCSF

ZINC36356943

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2009 22 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) 3.42 6.53 -10.16 1 4 0 49 313.426 2
Ref Reference (pH 7) 3.24 9.04 -8.38 1 4 0 45 313.426 2

Activity (Go SEA)

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