In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2010 | 17 | Yes |
Popular Name: (4S)-2-methyl-1-(3-pyridyl)-4,5,6,7-tetrahydroindol-4-amine (4S)-2-methyl-1-(3-pyridyl)-4,5,…
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) | -0.20 | 5.79 | -43.74 | 3 | 3 | 1 | 45 | 228.319 | 1 | ↓ |
Hi High (pH 8-9.5) | -0.20 | 5.49 | -5.91 | 2 | 3 | 0 | 44 | 227.311 | 1 | ↓ |