UCSF

ZINC00706963

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 26 Yes

Other Names:

MFCD02220940

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) 2.66 -5.36 -13.88 2 6 0 87 386.502 5
Lo Low (pH 4.5-6) 3.12 -6.42 -46.18 3 6 1 89 387.51 5

Activity (Go SEA)

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