UCSF

ZINC14523646

Substance Information

In ZINC since Heavy atoms Benign functionality
July 11th, 2008 27 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.76 9.04 -49.2 2 5 1 59 361.469 4
Lo Low (pH 4.5-6) 2.76 9.32 -96.33 3 5 2 61 362.477 4

Activity (Go SEA)

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