UCSF

ZINC00158095

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 12 Yes

Popular Name: 1H-indole-7-carboxylic acid 1H-indole-7-carboxylic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1670-83-3 , [1670-83-3]

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 1.68 4.26 -52.48 1 3 -1 56 160.152 1 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 202 - 204 Acros Organics
melting_point 204 KeyOrganics
MP 204 - 206 Enamine Building Blocks
MP 205 TCI
MP 205 - 207 Enamine Building Blocks
MP 205...207 Enamine Building Blocks
MP 206 - 207 Enamine Building Blocks
MP 207 - 207 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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