UCSF

ZINC03075301

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2004 16 No

CAS Number: 89840-63-1

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) 1.80 3.77 -13.36 1 6 0 92 244.272 5

Activity (Go SEA)

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