UCSF

ZINC00803883

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2004 27 Yes

Other Names:

MFCD03075753

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) 3.30 -4.08 -11.94 3 5 0 80 374.469 4
Lo Low (pH 4.5-6) 3.30 -3.96 -38.39 4 5 1 82 375.477 4

Activity (Go SEA)

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