UCSF

ZINC04692658

Substance Information

In ZINC since Heavy atoms Benign functionality
December 29th, 2005 28 No

CAS Numbers: 39032-62-7 , 76-66-4

Other Names:

isorhynchophylline

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) 2.83 9.49 -49.1 2 6 1 69 385.484 5
Hi High (pH 8-9.5) 2.83 7.64 -13.39 1 6 0 68 384.476 5

Vendor Notes

Note Type Comments Provided By
Target Muscarinic acetylcholine receptor M1(P11229)&Caspase-3(P42574)&Beta-nerve growth factor(P01138) Herbal Ingredients Targets

Activity (Go SEA)

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