In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 17 | Yes |
Popular Name: 2-[[(3S)-1,2,3,4-tetrahydroisoquinoline-3-carbonyl]amino]acetic 2-[[(3S)-1,2,3,4-tetrahydroisoqu…
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) | -1.08 | 2.47 | -42.02 | 2 | 5 | -1 | 81 | 233.247 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP1001764A1; WO1998053814A1 | IBM Patent Data |