In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 15 | Yes |
Popular Name: [(3R)-1-isopropyl-3-[[(1R)-1-methylpropyl]amino]pyrrolidin-3-yl]methanol [(3R)-1-isopropyl-3-[[(1R)-1-met…
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) | 1.57 | 2.56 | -30.72 | 3 | 3 | 1 | 37 | 215.361 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.57 | 3.4 | -96.06 | 4 | 3 | 2 | 41 | 216.369 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.57 | 1.98 | -32.87 | 3 | 3 | 1 | 40 | 215.361 | 5 | ↓ |