In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 20 | Yes |
Popular Name: 1-[(2R)-1-ethylpyrrolidin-2-yl]-N-[[4-(2-thienyl)-2-thienyl]methyl]methanamine 1-[(2R)-1-ethylpyrrolidin-2-yl]-…
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) | 3.70 | 9.14 | -30.42 | 2 | 2 | 1 | 16 | 307.508 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.70 | 6.88 | -3.87 | 1 | 2 | 0 | 15 | 306.5 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.70 | 8.61 | -39.29 | 2 | 2 | 1 | 20 | 307.508 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.70 | 10.4 | -117.61 | 3 | 2 | 2 | 21 | 308.516 | 6 | ↓ |