In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 16 | Yes |
Popular Name: (2R)-1-[[(3R)-1-cyclopropylpyrrolidin-3-yl]amino]-3-(dimethylamino)propan-2-ol (2R)-1-[[(3R)-1-cyclopropylpyrro…
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) | 0.00 | 2.95 | -77.54 | 4 | 4 | 2 | 41 | 229.368 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.00 | 0.42 | -32.24 | 3 | 4 | 1 | 40 | 228.36 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.00 | 0.6 | -34.55 | 3 | 4 | 1 | 40 | 228.36 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.00 | 1.79 | -102.95 | 4 | 4 | 2 | 45 | 229.368 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.00 | -0.72 | -40.16 | 3 | 4 | 1 | 43 | 228.36 | 6 | ↓ |