In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 21 | Yes |
Popular Name: (1R)-1-(3-methoxyphenyl)-N,N-dimethyl-N'-[(1-methylpyrazol-4-yl)methyl]ethane-1,2-diamine (1R)-1-(3-methoxyphenyl)-N,N-dim…
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) | 1.52 | 6.19 | -40.45 | 2 | 5 | 1 | 44 | 289.403 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.52 | 3.91 | -7.8 | 1 | 5 | 0 | 42 | 288.395 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.52 | 7.53 | -125.73 | 3 | 5 | 2 | 48 | 290.411 | 7 | ↓ |