In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | Yes |
Popular Name: 1-[4-[(2R)-2-amino-2-cyclopropyl-propanoyl]piperazin-1-yl]-2-methyl-propan-1-one 1-[4-[(2R)-2-amino-2-cyclopropyl…
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) | 0.71 | 3.49 | -55.81 | 3 | 5 | 1 | 68 | 268.381 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.71 | 3.21 | -12.13 | 2 | 5 | 0 | 67 | 267.373 | 3 | ↓ |