In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 19 | Yes |
Popular Name: (1S)-1-(2-methoxyphenyl)-N-[(3-methyl-1H-pyrazol-4-yl)methyl]propan-1-amine (1S)-1-(2-methoxyphenyl)-N-[(3-m…
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) | 1.59 | 6 | -39.39 | 3 | 4 | 1 | 55 | 260.361 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.59 | 5.2 | -6.37 | 2 | 4 | 0 | 50 | 259.353 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.59 | 5.17 | -5.72 | 2 | 4 | 0 | 50 | 259.353 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.59 | 5.98 | -38.37 | 3 | 4 | 1 | 55 | 260.361 | 6 | ↓ |