UCSF

ZINC18456286

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2008 34 No

Popular Name: Folinic acid calcium salt Folinic acid calcium salt

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1492-18-8 , 163254-40-8 , 41927-89-3 , 58-05-9 , 6035-45-6 , 80433-71-2 , [1492-18-8] , [58-05-9]

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) -3.04 4.75 -126.17 6 14 -2 225 471.43 9 ↓
Lo Low (pH 4.5-6) -3.04 2.15 -83.34 7 14 -1 223 472.438 9 ↓
Lo Low (pH 4.5-6) -3.04 2.78 -72.51 7 14 -1 223 472.438 9 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 3.00e-01 g/l DrugBank-approved
PUBCHEM_PATENT_ID EP0007597A1; EP0031237A1; EP0051278A1; EP0066284A2; EP0096560A1; EP0135955A2; EP0135955B1; EP0167263A1; EP0182765A2; EP0182765B1; EP0215063A1; EP0215063B1; EP0255228A1; EP0255228B1; EP0266042A2; EP0268377A2; EP0268377B1; EP0278686A1; EP0279565A1; EP027956 IBM Patent Data

Activity (Go SEA)

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