UCSF

ZINC04484064

Substance Information

In ZINC since Heavy atoms Benign functionality
December 4th, 2005 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) 2.70 5.69 -15.14 1 8 0 94 391.431 4
Ref Reference (pH 7) 2.70 6.16 -15.4 1 8 0 94 391.431 4
Ref Reference (pH 7) 2.70 5.65 -12.83 1 8 0 94 391.431 4

Activity (Go SEA)

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