UCSF

ZINC02073893

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 35 No

Other Names:

MFCD02071090

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) 8.20 17.35 -12.65 0 5 0 56 481.621 3
Ref Reference (pH 7) 8.20 15.06 -12.11 0 5 0 56 481.621 3
Lo Low (pH 4.5-6) 8.20 17.46 -22.4 1 5 1 58 482.629 3

Activity (Go SEA)

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