UCSF

ZINC00661660

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 30 Yes

Other Names:

MFCD03697718

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) 4.25 -1.72 -14.23 3 6 0 86 423.469 5
Lo Low (pH 4.5-6) 4.25 -1.61 -43.5 4 6 1 87 424.477 5

Activity (Go SEA)

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