UCSF

ZINC00019349

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 17 Yes

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) 0.17 1.84 -33.56 3 5 1 71 244.311 4
Hi High (pH 8-9.5) 0.17 0.43 -9.7 2 5 0 70 243.303 4

Activity (Go SEA)

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