In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 33 | Yes |
Popular Name: (3S)-1-[3-[(5-methylpyrazinoyl)-(2-morpholinoethyl)amino]propanoyl]nipecot-ethyl-ester (3S)-1-[3-[(5-methylpyrazinoyl)-…
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) | 0.64 | 7 | -14.37 | 0 | 10 | 0 | 105 | 461.563 | 10 | ↓ |
Mid Mid (pH 6-8) | 0.64 | 9.34 | -48.89 | 1 | 10 | 1 | 106 | 462.571 | 10 | ↓ |