In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 23 | Yes |
Popular Name: 2-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-ylmethyl)pyridine-3-carboxylic 2-(1,3,4,9-tetrahydropyrido[3,4-…
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) | 2.31 | 9.29 | -33.83 | 2 | 5 | 0 | 73 | 307.353 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.31 | 7.26 | -49.24 | 1 | 5 | -1 | 72 | 306.345 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.