UCSF

ZINC03993548

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2005 26 Yes

CAS Number: 100276-03-7

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) 3.24 12.32 -23.48 0 5 0 56 375.852 5

Activity (Go SEA)

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