In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (2S)-2-[[(2S)-3-amino-2-methyl-propyl]-methyl-amino]-1-(azepan-1-yl)propan-1-one (2S)-2-[[(2S)-3-amino-2-methyl-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) | 0.99 | 3.92 | -42.73 | 3 | 4 | 1 | 51 | 256.414 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.99 | 5.27 | -34.67 | 3 | 4 | 1 | 51 | 256.414 | 5 | ↓ |