In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 14 | Yes |
Popular Name: (2R)-1-amino-3-(4-isopropylpiperazin-1-yl)propan-2-ol (2R)-1-amino-3-(4-isopropylpiper…
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) | -0.93 | -0.96 | -85.91 | 5 | 4 | 2 | 56 | 203.33 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.93 | -3.2 | -43.26 | 4 | 4 | 1 | 54 | 202.322 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.93 | -3.56 | -3.3 | 3 | 4 | 0 | 53 | 201.314 | 4 | ↓ |