In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2010 | 29 | No |
Popular Name: [[[(2R)-3-amino-2-hydroxy-propyl]amino]-methoxy-methyl-dioxo-BLAHyl]methyl [[[(2R)-3-amino-2-hydroxy-propyl…
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) | -2.82 | -8.51 | -52.61 | 7 | 11 | 1 | 181 | 408.435 | 7 | ↓ |
Hi High (pH 8-9.5) | -2.82 | -8.9 | -14.46 | 6 | 11 | 0 | 179 | 407.427 | 7 | ↓ |
Hi High (pH 8-9.5) | -2.82 | -8.88 | -12.46 | 6 | 11 | 0 | 179 | 407.427 | 7 | ↓ |
Mid Mid (pH 6-8) | -2.82 | -8.53 | -58.2 | 7 | 11 | 1 | 181 | 408.435 | 7 | ↓ |