In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 19 | Yes |
Popular Name: (2S)-2-[(2S)-2-methylindolin-1-yl]-2-(5-methyl-2-thienyl)ethanamine (2S)-2-[(2S)-2-methylindolin-1-y…
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) | 2.87 | 7.91 | -47.06 | 3 | 2 | 1 | 31 | 273.425 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.87 | 7.2 | -4.68 | 2 | 2 | 0 | 29 | 272.417 | 3 | ↓ |