In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 20 | Yes |
Popular Name: 4-[(3S)-3-[[(2R)-1-ethylpyrrolidin-2-yl]methylamino]butyl]phenol 4-[(3S)-3-[[(2R)-1-ethylpyrrolid…
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) | 3.07 | 8.1 | -125.6 | 4 | 3 | 2 | 41 | 278.44 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.07 | 5.93 | -41.87 | 3 | 3 | 1 | 40 | 277.432 | 7 | ↓ |