In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 7th, 2010 | 17 | Yes |
Popular Name: [(2R)-1-[(1S,2S)-2-amino-1-(3-thienyl)butyl]pyrrolidin-2-yl]methanol [(2R)-1-[(1S,2S)-2-amino-1-(3-th…
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) | 1.01 | 1.43 | -43.27 | 4 | 3 | 1 | 51 | 255.407 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.01 | 3.12 | -107.82 | 5 | 3 | 2 | 52 | 256.415 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.01 | 2.8 | -29.27 | 4 | 3 | 1 | 51 | 255.407 | 5 | ↓ |