UCSF

ZINC19597346

Substance Information

In ZINC since Heavy atoms Benign functionality
November 5th, 2008 28 No

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) 2.63 3.63 -12.38 2 6 0 79 381.428 4
Lo Low (pH 4.5-6) 2.63 5.99 -49.95 3 6 1 80 382.436 4

Activity (Go SEA)

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