In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 21 | Yes |
Popular Name: (1S,2R)-2-[(3S)-3-(diethylamino)pyrrolidin-1-yl]tetralin-1-ol (1S,2R)-2-[(3S)-3-(diethylamino)…
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) | 2.55 | 6.01 | -33.53 | 2 | 3 | 1 | 28 | 289.443 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.55 | 5.82 | -34.34 | 2 | 3 | 1 | 28 | 289.443 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.55 | 8.17 | -106.69 | 3 | 3 | 2 | 29 | 290.451 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.