UCSF

ZINC36322077

Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2009 25 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 4.04 8.17 -52.47 3 4 1 54 350.364 5
Hi High (pH 8-9.5) 4.04 7.94 -8.03 2 4 0 53 349.356 5

Activity (Go SEA)

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