In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 11 | Yes |
Popular Name: (1S,3S)-3-methylolcyclopentanecarboxylic-acid-methyl-ester (1S,3S)-3-methylolcyclopentaneca…
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) | 0.96 | 2.11 | -6.22 | 1 | 3 | 0 | 47 | 158.197 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0933993A1 | IBM Patent Data |