In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 19 | Yes |
Popular Name: (3S)-1-[(3R)-1-isopropylpyrrolidin-3-yl]-3-[(2S)-pyrrolidin-2-yl]piperidine (3S)-1-[(3R)-1-isopropylpyrrolid…
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) | 2.11 | 6.72 | -80.86 | 3 | 3 | 2 | 24 | 267.461 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.11 | 8.08 | -102.09 | 3 | 3 | 2 | 21 | 267.461 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.11 | 4.3 | -36.51 | 2 | 3 | 1 | 23 | 266.453 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.11 | 6.46 | -97.02 | 3 | 3 | 2 | 24 | 267.461 | 3 | ↓ |