UCSF

ZINC16677014

Substance Information

In ZINC since Heavy atoms Benign functionality
September 4th, 2008 31 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) 1.27 2.99 -55.11 2 10 1 127 472.565 8
Hi High (pH 8-9.5) 1.27 2.2 -51.7 1 10 0 130 471.557 8

Activity (Go SEA)

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