UCSF

ZINC00039098

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 15 Yes

Popular Name: DL-INDOLE-3-LACTIC ACID DL-INDOLE-3-LACTIC ACID

Find On: PubMed — Wikipedia — Google

CAS Numbers: 101312-07-6 , 1821-52-9 , 832-97-3 , [7417-65-4] , [832-97-3]

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) 0.87 4.22 -47.05 2 4 -1 76 204.205 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 145 TCI
Mp [°C] 145 - 147 Acros Organics
ALOGPS_SOLUBILITY 2.12e+00 g/l DrugBank-experimental
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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