UCSF

ZINC02100376

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 27 No

Other Names:

MFCD01820916

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) 1.36 -4.94 -48.51 0 5 1 106 472.414 8

Activity (Go SEA)

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