In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2010 | 18 | Yes |
Popular Name: (4R)-2-methyl-1-(4-pyridylmethyl)-4,5,6,7-tetrahydroindol-4-amine (4R)-2-methyl-1-(4-pyridylmethyl…
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) | -0.31 | 6.14 | -41.55 | 3 | 3 | 1 | 45 | 242.346 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.31 | 5.81 | -7.13 | 2 | 3 | 0 | 44 | 241.338 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.31 | 6.59 | -85.97 | 4 | 3 | 2 | 47 | 243.354 | 2 | ↓ |