UCSF

ZINC01015100

Substance Information

In ZINC since Heavy atoms Benign functionality
December 24th, 2005 26 No

Other Names:

MFCD03082916

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) 5.51 10.04 -8.97 0 5 0 53 366.442 3
Ref Reference (pH 7) 5.51 9.63 -9.08 0 5 0 53 366.442 3

Activity (Go SEA)

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