In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 17 | Yes |
Popular Name: [(3S)-3-(cyclohexylamino)-1-isopropyl-pyrrolidin-3-yl]methanol [(3S)-3-(cyclohexylamino)-1-isop…
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) | 2.26 | 3.43 | -33.75 | 3 | 3 | 1 | 37 | 241.399 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.26 | 4.91 | -104.9 | 4 | 3 | 2 | 41 | 242.407 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.26 | 3.32 | -34.81 | 3 | 3 | 1 | 40 | 241.399 | 4 | ↓ |