UCSF

ZINC13471663

Substance Information

In ZINC since Heavy atoms Benign functionality
June 20th, 2008 23 No

Other Names:

MFCD03866870

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) 2.64 7.89 -8.7 1 5 0 62 333.457 6
Ref Reference (pH 7) 2.64 7.24 -9.79 1 5 0 62 333.457 6

Activity (Go SEA)

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