In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 20 | Yes |
Popular Name: (1S,2R)-1-indolin-1-yl-1-(3-methyl-2-thienyl)butan-2-amine (1S,2R)-1-indolin-1-yl-1-(3-meth…
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) | 3.63 | 8.25 | -43.9 | 3 | 2 | 1 | 31 | 287.452 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.63 | 7.8 | -4.16 | 2 | 2 | 0 | 29 | 286.444 | 4 | ↓ |