UCSF

ZINC04494831

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 5th, 2005 23 No

Popular Name: BRD-A52600254-001-01-2 BRD-A52600254-001-01-2

Find On: PubMed — Wikipedia — Google

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) 1.84 3.17 -9.19 3 6 0 101 304.309 2 ↓
Ref Reference (pH 7) 1.84 2.48 -8.74 3 6 0 101 304.309 2 ↓
Lo Low (pH 4.5-6) 1.84 3.41 -56.11 4 6 1 102 305.317 2 ↓

Activity (Go SEA)

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