In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 21 | Yes |
Popular Name: 3-[(1S)-1-[[(3R)-1-cyclopropylpyrrolidin-3-yl]amino]ethyl]benzenesulfonamide 3-[(1S)-1-[[(3R)-1-cyclopropylpy…
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) | 1.24 | 2.78 | -41.94 | 4 | 5 | 1 | 77 | 310.443 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.24 | 0.39 | -9.39 | 3 | 5 | 0 | 75 | 309.435 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.24 | 1.39 | -49.8 | 4 | 5 | 1 | 80 | 310.443 | 5 | ↓ |