UCSF

ZINC00368724

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 22 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) 4.91 9.5 -6 1 3 0 53 296.414 4
Lo Low (pH 4.5-6) 5.10 8.2 -36.89 2 3 1 58 297.422 4

Activity (Go SEA)

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