In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 27 | Yes |
Popular Name: [[(2R)-3-tert-butoxy-2-hydroxy-propyl]-cyclopropyl-amino]methylBLAHone [[(2R)-3-tert-butoxy-2-hydroxy-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) | 2.20 | 7.56 | -51.48 | 3 | 6 | 1 | 80 | 392.545 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.66 | 4.76 | -49.05 | 2 | 6 | 0 | 83 | 391.537 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.20 | 5.45 | -13.56 | 2 | 6 | 0 | 78 | 391.537 | 8 | ↓ |