UCSF

ZINC11680536

Substance Information

In ZINC since Heavy atoms Benign functionality
March 3rd, 2008 34 Yes

CAS Number: 51876-98-3

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) 2.17 -9.65 -24.75 3 10 0 130 491.614 9

Activity (Go SEA)

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