In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2010 | 20 | Yes |
Popular Name: (4R)-6,6-dimethyl-1-[(1S)-1-(4-pyridyl)ethyl]-5,7-dihydro-4H-indol-4-amine (4R)-6,6-dimethyl-1-[(1S)-1-(4-p…
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) | 0.72 | 6.9 | -41.99 | 3 | 3 | 1 | 45 | 270.4 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.72 | 6.59 | -6.32 | 2 | 3 | 0 | 44 | 269.392 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.72 | 7.35 | -86.26 | 4 | 3 | 2 | 47 | 271.408 | 2 | ↓ |