In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 19 | Yes |
Popular Name: (3S)-N-[(3-bromo-4-methoxy-phenyl)methyl]-1-cyclopropyl-pyrrolidin-3-amine (3S)-N-[(3-bromo-4-methoxy-pheny…
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) | 2.81 | 7.03 | -35.25 | 2 | 3 | 1 | 26 | 326.258 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.81 | 4.69 | -4.76 | 1 | 3 | 0 | 24 | 325.25 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.81 | 5.86 | -46.08 | 2 | 3 | 1 | 29 | 326.258 | 5 | ↓ |