In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2010 | 23 | Yes |
Popular Name: 1-(4-methoxy-3,5-dimethyl-2-pyridyl)-N-(1-naphthylmethyl)methanamine 1-(4-methoxy-3,5-dimethyl-2-pyri…
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) | 4.08 | 9.11 | -44.24 | 2 | 3 | 1 | 39 | 307.417 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.08 | 7.71 | -6.68 | 1 | 3 | 0 | 34 | 306.409 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.08 | 9.63 | -119.74 | 3 | 3 | 2 | 40 | 308.425 | 5 | ↓ |