In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2010 | 13 | Yes |
Popular Name: 3-Hydroxy-1h-indole-2-carboxylic acid 3-Hydroxy-1h-indole-2-carboxylic…
1H-Indole-2-carboxylic acid, 2,3-dihydro-3-oxo- (9CI)
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) | -1.09 | 3.52 | -49.29 | 1 | 4 | -1 | 69 | 176.151 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.44 | 3.43 | -138.5 | 0 | 4 | -2 | 76 | 175.143 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.44 | 3.43 | -138.54 | 0 | 4 | -2 | 76 | 175.143 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.