In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 1st, 2008 | 23 | Yes |
Popular Name: 1-(3-fluorophenyl)-N-(3-pyridylmethyl)-N-(4-pyridylmethyl)methanamine 1-(3-fluorophenyl)-N-(3-pyridylm…
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) | 2.15 | 7.98 | -8.75 | 0 | 3 | 0 | 29 | 307.372 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.15 | 9.63 | -115.17 | 2 | 3 | 2 | 31 | 309.388 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.15 | 9.63 | -113.5 | 2 | 3 | 2 | 31 | 309.388 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.15 | 9.91 | -196.46 | 3 | 3 | 3 | 33 | 310.396 | 6 | ↓ |