UCSF

ZINC37540387

Substance Information

In ZINC since Heavy atoms Benign functionality
November 26th, 2009 31 Yes

CAS Number: 84985-78-4

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) 5.75 8.76 -3.92 3 3 0 61 430.673 6

Activity (Go SEA)

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