In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 29 | No |
Popular Name: (2S)-2-amino-1-(4,7,10,13,16-pentaoxa-1-azacyclooctadec-1-yl)-3-phenyl-propan-1-one (2S)-2-amino-1-(4,7,10,13,16-pen…
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) | -0.64 | 2.89 | -44.97 | 3 | 8 | 1 | 94 | 411.519 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.64 | 2.57 | -10.61 | 2 | 8 | 0 | 93 | 410.511 | 3 | ↓ |