UCSF

ZINC00661652

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 28 Yes

Other Names:

MFCD03697715

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) 5.37 -1.43 -10.01 3 4 0 68 415.852 3
Lo Low (pH 4.5-6) 5.37 -1.31 -38.48 4 4 1 69 416.86 3

Activity (Go SEA)

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