In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 20 | Yes |
Popular Name: 3-[(1S)-1-(2-pyrrolidin-1-ylethylamino)ethyl]benzenesulfonamide 3-[(1S)-1-(2-pyrrolidin-1-ylethy…
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) | 1.16 | 0.84 | -51.49 | 4 | 5 | 1 | 80 | 298.432 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.16 | -0.28 | -9.32 | 3 | 5 | 0 | 75 | 297.424 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.16 | 3.27 | -131.12 | 5 | 5 | 2 | 81 | 299.44 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.16 | 2.18 | -42.9 | 4 | 5 | 1 | 77 | 298.432 | 6 | ↓ |