In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 16 | Yes |
Popular Name: (2R)-1-[cyclopentyl(ethyl)amino]-3-(cyclopropylamino)propan-2-ol (2R)-1-[cyclopentyl(ethyl)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) | 1.62 | 5.3 | -98.57 | 4 | 3 | 2 | 41 | 228.38 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.62 | 5.76 | -35.78 | 3 | 3 | 1 | 44 | 227.372 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.62 | 4 | -31.88 | 3 | 3 | 1 | 37 | 227.372 | 7 | ↓ |