UCSF

ZINC00987282

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2004 25 Yes

Other Names:

MFCD03666442

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) 3.62 -1.53 -15.33 0 5 0 57 357.479 2
Lo Low (pH 4.5-6) 3.62 -1.49 -34.11 1 5 1 58 358.487 2

Activity (Go SEA)

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