UCSF

ZINC01508682

Substance Information

In ZINC since Heavy atoms Benign functionality
August 20th, 2004 23 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) 2.86 2.71 -10.15 1 5 0 71 373.206 3
Ref Reference (pH 7) 2.67 5.4 -13.04 1 5 0 68 373.206 3

Activity (Go SEA)

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