UCSF

ZINC08214744

Substance Information

In ZINC since Heavy atoms Benign functionality
July 4th, 2006 38 No

CAS Number: 466-07-9

Other Names:

BRD-A31385885-001-02-1

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 -5.5 -17.66 3 8 0 114 534.69 4

Vendor Notes

Note Type Comments Provided By
Therapy cardiotonic, antineoplastic SMDC MicroSource

Activity (Go SEA)

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