In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 14 | Yes |
Popular Name: (2R)-1-[butyl(cyclopropyl)amino]-3-(methylamino)propan-2-ol (2R)-1-[butyl(cyclopropyl)amino]…
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) | 1.29 | 4.23 | -97.28 | 4 | 3 | 2 | 41 | 202.342 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.29 | 2.78 | -32.06 | 3 | 3 | 1 | 37 | 201.334 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.29 | 4.72 | -37.59 | 3 | 3 | 1 | 44 | 201.334 | 8 | ↓ |