UCSF

ZINC01384914

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 20 Yes

Popular Name: BRD-K21779611-001-01-8 BRD-K21779611-001-01-8

Find On: PubMed — Wikipedia — Google

CAS Number: 245039-20-7

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) 3.48 10.03 -11.14 1 5 0 55 261.288 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 244 - 247 KeyOrganics

Activity (Go SEA)

Rings

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